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    O O HN N N CH 3
    Y17
    Name:5-{2-[(3R)-1-methyl-5-oxopyrrolidin-3-yl]ethyl}-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indol-1-one
    Formula:C18 H21 N3 O2
    SMILES:CN4C(CC(CCn3c1c(cccc1)c2C(NCCc23)=O)C4)=O
    InChi:InChI=1S/C18H21N3O2/c1-20-11-12(10-16(20)22)7-9-21-14-5-3-2-4-13(14)17-15(21)6-8-19-18(17)23/h2-5,12H,6-11H2,1H3,(H,19,23)/t12-/m1/s1
    Definition date:2019-07-12
    Last modified:2019-11-22
    Release date:2019-11-27
    Identifier:5-{2-[(3R)-1-methyl-5-oxopyrrolidin-3-yl]ethyl}-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indol-1-one
    O O N N N H CH 3
    Y18
    Name:5-{[(3R)-1-methyl-5-oxopyrrolidin-3-yl]methyl}-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indol-1-one
    Formula:C17 H19 N3 O2
    SMILES:C1(=O)c3c(CCN1)n(CC2CC(N(C2)C)=O)c4c3cccc4
    InChi:InChI=1S/C17H19N3O2/c1-19-9-11(8-15(19)21)10-20-13-5-3-2-4-12(13)16-14(20)6-7-18-17(16)22/h2-5,11H,6-10H2,1H3,(H,18,22)/t11-/m0/s1
    Definition date:2019-07-12
    Last modified:2019-11-22
    Release date:2019-11-27
    Identifier:5-{[(3R)-1-methyl-5-oxopyrrolidin-3-yl]methyl}-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indol-1-one
    H 3 C NH O OH HO O OH
    YYR
    Name:2-(acetylamino)-1,5-anhydro-2-deoxy-D-mannitol
    Formula:C8 H15 N O5
    SMILES:O=C(NC1C(O)C(O)C(OC1)CO)C
    InChi:InChI=1S/C8H15NO5/c1-4(11)9-5-3-14-6(2-10)8(13)7(5)12/h5-8,10,12-13H,2-3H2,1H3,(H,9,11)/t5-,6-,7-,8-/m1/s1
    Definition date:2012-12-18
    Last modified:2019-11-20
    Release date:2019-11-20
    Identifier:2-(acetylamino)-1,5-anhydro-2-deoxy-D-mannitol
    NH 2 OH O H 3 C O
    5R5
    Name:methyl L-serinate
    Formula:C4 H9 N O3
    SMILES:NC(C(=O)OC)CO
    InChi:InChI=1S/C4H9NO3/c1-8-4(7)3(5)2-6/h3,6H,2,5H2,1H3/t3-/m0/s1
    Synonyms:methyl (2~{S})-2-azanyl-3-oxidanyl-propanoate
    Definition date:2015-11-13
    Last modified:2019-11-19
    Release date:2015-12-16
    Identifier:methyl L-serinate
    NH 2 O N CH 3 CH 3 OH
    ELY
    Name:N~6~,N~6~-diethyl-L-lysine
    Formula:C10 H22 N2 O2
    SMILES:C(=O)(C(N)CCCCN(CC)CC)O
    InChi:InChI=1S/C10H22N2O2/c1-3-12(4-2)8-6-5-7-9(11)10(13)14/h9H,3-8,11H2,1-2H3,(H,13,14)/t9-/m0/s1
    Synonyms:(2S)-2-azanyl-6-(diethylamino)hexanoic acid
    Definition date:2011-03-25
    Last modified:2019-11-19
    Identifier:N~6~,N~6~-diethyl-L-lysine
    Br O Br
    PBP
    Name:p-Bromophenacyl bromide
    Formula:C8 H6 Br2 O
    SMILES:C(C(c1ccc(cc1)Br)=O)Br
    InChi:InChI=1S/C8H6Br2O/c9-5-8(11)6-1-3-7(10)4-2-6/h1-4H,5H2
    Definition date:1999-07-08
    Last modified:2019-11-18
    Identifier:2-bromo-1-(4-bromophenyl)ethan-1-one
    N O NH 2 N N N H 3 C N NH O N H CH 3 O H 3 C
    C6F
    Name:6-ethyl-3-[[3-methoxy-4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]phenyl]amino]-5-(oxan-4-ylamino)pyrazine-2-carboxamide
    Formula:C29 H44 N8 O3
    SMILES:CCc1nc(C(N)=O)c(Nc2ccc(N3CCC(CC3)N4CCN(C)CC4)c(OC)c2)nc1NC5CCOCC5
    InChi:InChI=1S/C29H44N8O3/c1-4-23-28(31-20-9-17-40-18-10-20)34-29(26(33-23)27(30)38)32-21-5-6-24(25(19-21)39-3)37-11-7-22(8-12-37)36-15-13-35(2)14-16-36/h5-6,19-20,22H,4,7-18H2,1-3H3,(H2,30,38)(H2,31,32,34)
    Synonyms:gilteritinib
    Definition date:2019-04-10
    Last modified:2019-11-15
    Release date:2019-11-20
    Identifier:6-ethyl-3-[[3-methoxy-4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]phenyl]amino]-5-(oxan-4-ylamino)pyrazine-2-carboxamide
    S O O H 2 N N H 3 C CH 3
    CQO
    Name:3-(2,7-dimethoxyacridin-9-yl)sulfanylpropan-1-amine
    Formula:C18 H20 N2 O2 S
    SMILES:COc1ccc2nc3ccc(OC)cc3c(SCCCN)c2c1
    InChi:InChI=1S/C18H20N2O2S/c1-21-12-4-6-16-14(10-12)18(23-9-3-8-19)15-11-13(22-2)5-7-17(15)20-16/h4-7,10-11H,3,8-9,19H2,1-2H3
    Definition date:2019-05-14
    Last modified:2019-11-15
    Release date:2019-11-20
    Identifier:3-(2,7-dimethoxyacridin-9-yl)sulfanylpropan-1-amine
    O CH 3 O OH HO OH OH H 2 C CH 3 O HO
    DX0
    Name:Steviolmonoside
    Formula:C26 H40 O8
    SMILES:C[C]12CCC[C](C)([CH]1CC[C]34CC(=C)[C](CC[CH]23)(C4)O[CH]5O[CH](CO)[CH](O)[CH](O)[CH]5O)C(O)=O
    Definition date:2019-09-17
    Last modified:2019-11-15
    Release date:2019-11-20
    N H H 2 N O S HN O F F F Cl O O
    GZE
    Name:[4-[[4-chloranyl-3-(trifluoromethyl)phenyl]carbamoylamino]phenyl] sulfamate
    Formula:C14 H11 Cl F3 N3 O4 S
    SMILES:N[S](=O)(=O)Oc1ccc(NC(=O)Nc2ccc(Cl)c(c2)C(F)(F)F)cc1
    InChi:InChI=1S/C14H11ClF3N3O4S/c15-12-6-3-9(7-11(12)14(16,17)18)21-13(22)20-8-1-4-10(5-2-8)25-26(19,23)24/h1-7H,(H2,19,23,24)(H2,20,21,22)
    Definition date:2018-10-26
    Last modified:2019-11-15
    Release date:2019-11-20
    Identifier:[4-[[4-chloranyl-3-(trifluoromethyl)phenyl]carbamoylamino]phenyl] sulfamate
    NH 2 Cl F F F O O S HN HN O
    GZH
    Name:1-[4-chloranyl-3-(trifluoromethyl)phenyl]-3-[2-(4-sulfamoylphenyl)ethyl]urea
    Formula:C16 H15 Cl F3 N3 O3 S
    SMILES:N[S](=O)(=O)c1ccc(CCNC(=O)Nc2ccc(Cl)c(c2)C(F)(F)F)cc1
    InChi:InChI=1S/C16H15ClF3N3O3S/c17-14-6-3-11(9-13(14)16(18,19)20)23-15(24)22-8-7-10-1-4-12(5-2-10)27(21,25)26/h1-6,9H,7-8H2,(H2,21,25,26)(H2,22,23,24)
    Definition date:2018-10-26
    Last modified:2019-11-15
    Release date:2019-11-20
    Identifier:1-[4-chloranyl-3-(trifluoromethyl)phenyl]-3-[2-(4-sulfamoylphenyl)ethyl]urea
    HN Cl O HN N N N N O O H 3 C Cl N
    H0W
    Name:6-chloranyl-3-[3-[(1~{S})-1-(4-chlorophenyl)ethyl]-5-phenyl-imidazol-4-yl]-~{N}-[2-[4-(2-oxidanylidene-1,3-oxazinan-3-yl)piperidin-1-yl]pyridin-3-yl]-1~{H}-indole-2-carboxamide
    Formula:C40 H37 Cl2 N7 O3
    SMILES:C[CH](n1cnc(c2ccccc2)c1c3c([nH]c4cc(Cl)ccc34)C(=O)Nc5cccnc5N6CCC(CC6)N7CCCOC7=O)c8ccc(Cl)cc8
    InChi:InChI=1S/C40H37Cl2N7O3/c1-25(26-10-12-28(41)13-11-26)49-24-44-35(27-7-3-2-4-8-27)37(49)34-31-15-14-29(42)23-33(31)45-36(34)39(50)46-32-9-5-18-43-38(32)47-20-16-30(17-21-47)48-19-6-22-52-40(48)51/h2-5,7-15,18,23-25,30,45H,6,16-17,19-22H2,1H3,(H,46,50)/t25-/m0/s1
    Definition date:2018-11-01
    Last modified:2019-11-15
    Release date:2019-11-20
    Identifier:6-chloranyl-3-[3-[(1~{S})-1-(4-chlorophenyl)ethyl]-5-phenyl-imidazol-4-yl]-~{N}-[2-[4-(2-oxidanylidene-1,3-oxazinan-3-yl)piperidin-1-yl]pyridin-3-yl]-1~{H}-indole-2-carboxamide
    O S O NH 2 O CH 3
    H1Z
    Name:4-butoxybenzenesulfonamide
    Formula:C10 H15 N O3 S
    SMILES:CCCCOc1ccc(cc1)[S](N)(=O)=O
    InChi:InChI=1S/C10H15NO3S/c1-2-3-8-14-9-4-6-10(7-5-9)15(11,12)13/h4-7H,2-3,8H2,1H3,(H2,11,12,13)
    Definition date:2018-11-05
    Last modified:2019-11-15
    Release date:2019-11-20
    Identifier:4-butoxybenzenesulfonamide
    CH 3 H 3 C CH 3 OH O O S Si
    H3B
    Name:3-trimethylsilylpropane-1-sulfonic acid
    Formula:C6 H16 O3 S Si
    SMILES:C[Si](C)(C)CCC[S](O)(=O)=O
    InChi:InChI=1S/C6H16O3SSi/c1-11(2,3)6-4-5-10(7,8)9/h4-6H2,1-3H3,(H,7,8,9)
    Definition date:2018-11-12
    Last modified:2019-11-15
    Release date:2019-11-20
    Identifier:3-trimethylsilylpropane-1-sulfonic acid
    N H Br
    H4N
    Name:5-bromanyl-1~{H}-indole
    Formula:C8 H6 Br N
    SMILES:Brc1ccc2[nH]ccc2c1
    InChi:InChI=1S/C8H6BrN/c9-7-1-2-8-6(5-7)3-4-10-8/h1-5,10H
    Definition date:2018-11-15
    Last modified:2019-11-15
    Release date:2019-11-20
    Identifier:5-bromanyl-1~{H}-indole
    OH _ B HO O OH O
    HJB
    Name:3-[7,7-bis(oxidanyl)-8-oxa-7-boranuidabicyclo[4.3.0]nona-1(6),2,4-trien-5-yl]propanoic acid
    Formula:C10 H12 B O5
    SMILES:OC(=O)CCc1cccc2CO[B-](O)(O)c12
    InChi:InChI=1S/C10H12BO5/c12-9(13)5-4-7-2-1-3-8-6-16-11(14,15)10(7)8/h1-3,14-15H,4-6H2,(H,12,13)/q-1
    Definition date:2018-12-07
    Last modified:2019-11-15
    Release date:2019-11-20
    Identifier:3-[7,7-bis(oxidanyl)-8-oxa-7-boranuidabicyclo[4.3.0]nona-1(6),2,4-trien-5-yl]propanoic acid
    O N H CH 3
    HLH
    Name:2-heptyl-1~{H}-quinolin-4-one
    Formula:C16 H21 N O
    SMILES:CCCCCCCC1=CC(=O)c2ccccc2N1
    InChi:InChI=1S/C16H21NO/c1-2-3-4-5-6-9-13-12-16(18)14-10-7-8-11-15(14)17-13/h7-8,10-12H,2-6,9H2,1H3,(H,17,18)
    Definition date:2018-12-13
    Last modified:2019-11-15
    Release date:2019-11-20
    Identifier:2-heptyl-1~{H}-quinolin-4-one
    NH N H 2 N F F F F
    HLK
    Name:~{N}4-[(4-fluorophenyl)methyl]-6-(trifluoromethyl)pyridine-2,4-diamine
    Formula:C13 H11 F4 N3
    SMILES:Nc1cc(NCc2ccc(F)cc2)cc(n1)C(F)(F)F
    InChi:InChI=1S/C13H11F4N3/c14-9-3-1-8(2-4-9)7-19-10-5-11(13(15,16)17)20-12(18)6-10/h1-6H,7H2,(H3,18,19,20)
    Definition date:2018-12-13
    Last modified:2019-11-15
    Release date:2019-11-20
    Identifier:~{N}4-[(4-fluorophenyl)methyl]-6-(trifluoromethyl)pyridine-2,4-diamine
    NH 2 N N H F F F F
    HLQ
    Name:~{N}4-[3-(4-fluorophenyl)propyl]-6-(trifluoromethyl)pyridine-2,4-diamine
    Formula:C15 H15 F4 N3
    SMILES:Nc1cc(NCCCc2ccc(F)cc2)cc(n1)C(F)(F)F
    InChi:InChI=1S/C15H15F4N3/c16-11-5-3-10(4-6-11)2-1-7-21-12-8-13(15(17,18)19)22-14(20)9-12/h3-6,8-9H,1-2,7H2,(H3,20,21,22)
    Definition date:2018-12-13
    Last modified:2019-11-15
    Release date:2019-11-20
    Identifier:~{N}4-[3-(4-fluorophenyl)propyl]-6-(trifluoromethyl)pyridine-2,4-diamine
    H 3 C HO P O O O O O O OH O HN NH NH N H CH 3 CH 3 CH 3
    JQG
    Name:(2~{R})-~{N}-[3-[2-[[(2~{S})-2-formamido-3-methyl-butanoyl]amino]ethylamino]-3-oxidanylidene-propyl]-3,3-dimethyl-2-oxidanyl-4-[oxidanyl-bis(oxidanylidene)-$l^{6}-phosphanyl]oxy-butanamide
    Formula:C17 H32 N4 O9 P
    SMILES:CC(C)[CH](NC=O)C(=O)NCCNC(=O)CCNC(=O)[CH](O)C(C)(C)CO[P](O)(=O)=O
    InChi:InChI=1S/C17H32N4O9P/c1-11(2)13(21-10-22)15(25)20-8-7-18-12(23)5-6-19-16(26)14(24)17(3,4)9-30-31(27,28)29/h10-11,13-14,24H,5-9H2,1-4H3,(H,18,23)(H,19,26)(H,20,25)(H,21,22)(H,27,28,29)/t13-,14-/m0/s1
    Definition date:2018-09-13
    Last modified:2019-11-15
    Release date:2019-11-20
    Identifier:(2~{R})-~{N}-[3-[2-[[(2~{S})-2-formamido-3-methyl-butanoyl]amino]ethylamino]-3-oxidanylidene-propyl]-3,3-dimethyl-2-oxidanyl-4-[oxidanyl-bis(oxidanylidene)-$l^{6}-phosphanyl]oxy-butanamide
    F F O HN N H O
    K9V
    Name:N-{cis-4-[(2,6-difluorophenyl)methoxy]cyclohexyl}-N'-(3-phenylpropyl)urea
    Formula:C23 H28 F2 N2 O2
    SMILES:c3ccc(CCCNC(=O)NC1CCC(CC1)OCc2c(F)cccc2F)cc3
    InChi:InChI=1S/C23H28F2N2O2/c24-21-9-4-10-22(25)20(21)16-29-19-13-11-18(12-14-19)27-23(28)26-15-5-8-17-6-2-1-3-7-17/h1-4,6-7,9-10,18-19H,5,8,11-16H2,(H2,26,27,28)/t18-,19+
    Definition date:2018-11-16
    Last modified:2019-11-15
    Release date:2019-11-20
    Identifier:N-{cis-4-[(2,6-difluorophenyl)methoxy]cyclohexyl}-N'-(3-phenylpropyl)urea
    F F F O N H O N H O O HN CH 3
    KC4
    Name:N-methyl-4-{[trans-4-({[4-(trifluoromethoxy)phenyl]carbamoyl}amino)cyclohexyl]oxy}benzamide
    Formula:C22 H24 F3 N3 O4
    SMILES:C2(CCC(NC(=O)Nc1ccc(cc1)OC(F)(F)F)CC2)Oc3ccc(C(NC)=O)cc3
    InChi:InChI=1S/C22H24F3N3O4/c1-26-20(29)14-2-8-17(9-3-14)31-18-10-4-15(5-11-18)27-21(30)28-16-6-12-19(13-7-16)32-22(23,24)25/h2-3,6-9,12-13,15,18H,4-5,10-11H2,1H3,(H,26,29)(H2,27,28,30)/t15-,18-
    Definition date:2018-11-19
    Last modified:2019-11-15
    Release date:2019-11-20
    Identifier:N-methyl-4-{[trans-4-({[4-(trifluoromethoxy)phenyl]carbamoyl}amino)cyclohexyl]oxy}benzamide
    N N F F F O HN O
    KDS
    Name:4-[(quinolin-3-yl)methyl]-N-[4-(trifluoromethoxy)phenyl]piperidine-1-carboxamide
    Formula:C23 H22 F3 N3 O2
    SMILES:c4c(ccc(NC(=O)N1CCC(CC1)Cc3cnc2ccccc2c3)c4)OC(F)(F)F
    InChi:InChI=1S/C23H22F3N3O2/c24-23(25,26)31-20-7-5-19(6-8-20)28-22(30)29-11-9-16(10-12-29)13-17-14-18-3-1-2-4-21(18)27-15-17/h1-8,14-16H,9-13H2,(H,28,30)
    Definition date:2018-11-26
    Last modified:2019-11-15
    Release date:2019-11-20
    Identifier:4-[(quinolin-3-yl)methyl]-N-[4-(trifluoromethoxy)phenyl]piperidine-1-carboxamide
    O NH 2 N H O H 3 C
    KJ1
    Name:N-(8-amino-8-oxooctyl)nonanamide
    Formula:C17 H34 N2 O2
    SMILES:C(CNC(CCCCCCCC)=O)CCCCCC(=O)N
    InChi:InChI=1S/C17H34N2O2/c1-2-3-4-5-8-11-14-17(21)19-15-12-9-6-7-10-13-16(18)20/h2-15H2,1H3,(H2,18,20)(H,19,21)
    Definition date:2018-12-10
    Last modified:2019-11-15
    Release date:2019-11-20
    Identifier:N-(8-amino-8-oxooctyl)nonanamide
    CH 3 N HO H 3 C N N F N H O
    L1H
    Name:3-fluoranyl-~{N}-[1-(2-methyl-2-oxidanyl-propyl)benzimidazol-2-yl]-5-pyridin-3-yl-benzamide
    Formula:C23 H21 F N4 O2
    SMILES:CC(C)(O)Cn1c(NC(=O)c2cc(F)cc(c2)c3cccnc3)nc4ccccc14
    InChi:InChI=1S/C23H21FN4O2/c1-23(2,30)14-28-20-8-4-3-7-19(20)26-22(28)27-21(29)17-10-16(11-18(24)12-17)15-6-5-9-25-13-15/h3-13,30H,14H2,1-2H3,(H,26,27,29)
    Definition date:2019-07-12
    Last modified:2019-11-15
    Release date:2019-11-20
    Identifier:3-fluoranyl-~{N}-[1-(2-methyl-2-oxidanyl-propyl)benzimidazol-2-yl]-5-pyridin-3-yl-benzamide