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EVW

EVW
Name:	2-azanyl-~{N}-(diphenylmethyl)-1,3-benzothiazole-6-carboxamide
Formula:	C21 H17 N3 O S
SMILES:	Nc1sc2cc(ccc2n1)C(=O)NC(c3ccccc3)c4ccccc4
InChi:	InChI=1S/C21H17N3OS/c22-21-23-17-12-11-16(13-18(17)26-21)20(25)24-19(14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-13,19H,(H2,22,23)(H,24,25)
Definition date:	2018-04-25
Last modified:	2019-03-29
Release date:	2019-04-03
Identifier:	2-azanyl-~{N}-(diphenylmethyl)-1,3-benzothiazole-6-carboxamide

EVZ

EVZ
Name:	methyl 1-[4-[(2-azanyl-1,3-benzothiazol-6-yl)sulfanylmethyl]phenyl]carbonylpiperidine-4-carboxylate
Formula:	C22 H23 N3 O3 S2
SMILES:	COC(=O)C1CCN(CC1)C(=O)c2ccc(CSc3ccc4nc(N)sc4c3)cc2
InChi:	InChI=1S/C22H23N3O3S2/c1-28-21(27)16-8-10-25(11-9-16)20(26)15-4-2-14(3-5-15)13-29-17-6-7-18-19(12-17)30-22(23)24-18/h2-7,12,16H,8-11,13H2,1H3,(H2,23,24)
Definition date:	2018-04-26
Last modified:	2019-03-29
Release date:	2019-04-03
Identifier:	methyl 1-[4-[(2-azanyl-1,3-benzothiazol-6-yl)sulfanylmethyl]phenyl]carbonylpiperidine-4-carboxylate

EWK

EWK
Name:	4-[(2-azanyl-1,3-benzothiazol-6-yl)sulfanylmethyl]-~{N}-(phenylmethyl)benzamide
Formula:	C22 H19 N3 O S2
SMILES:	Nc1sc2cc(SCc3ccc(cc3)C(=O)NCc4ccccc4)ccc2n1
InChi:	InChI=1S/C22H19N3OS2/c23-22-25-19-11-10-18(12-20(19)28-22)27-14-16-6-8-17(9-7-16)21(26)24-13-15-4-2-1-3-5-15/h1-12H,13-14H2,(H2,23,25)(H,24,26)
Definition date:	2018-04-27
Last modified:	2019-03-29
Release date:	2019-04-03
Identifier:	4-[(2-azanyl-1,3-benzothiazol-6-yl)sulfanylmethyl]-~{N}-(phenylmethyl)benzamide

EWT

EWT
Name:	2-azanyl-~{N}-[(3,4-dichlorophenyl)methyl]-1,3-benzothiazole-6-carboxamide
Formula:	C15 H11 Cl2 N3 O S
SMILES:	Nc1sc2cc(ccc2n1)C(=O)NCc3ccc(Cl)c(Cl)c3
InChi:	InChI=1S/C15H11Cl2N3OS/c16-10-3-1-8(5-11(10)17)7-19-14(21)9-2-4-12-13(6-9)22-15(18)20-12/h1-6H,7H2,(H2,18,20)(H,19,21)
Definition date:	2018-04-27
Last modified:	2019-03-29
Release date:	2019-04-03
Identifier:	2-azanyl-~{N}-[(3,4-dichlorophenyl)methyl]-1,3-benzothiazole-6-carboxamide

Z3P

Z3P
Name:	3,3',3''-phosphoryltripropanoic acid
Formula:	C9 H15 O7 P
SMILES:	O=C(O)CCP(=O)(CCC(=O)O)CCC(=O)O
InChi:	InChI=1S/C9H15O7P/c10-7(11)1-4-17(16,5-2-8(12)13)6-3-9(14)15/h1-6H2,(H,10,11)(H,12,13)(H,14,15)
Definition date:	2016-05-11
Last modified:	2019-03-22
Release date:	2019-03-27
Identifier:	3,3',3''-phosphoryltripropanoic acid

FVV

FVV
Name:	10-[(4-fluorophenyl)methyl]-2,3,4,10-tetrahydropyrimido[1,2-a]benzimidazole
Formula:	C17 H16 F N3
SMILES:	c4(ccc(CN3C=1N(CCCN=1)c2c3cccc2)cc4)F
InChi:	InChI=1S/C17H16FN3/c18-14-8-6-13(7-9-14)12-21-16-5-2-1-4-15(16)20-11-3-10-19-17(20)21/h1-2,4-9H,3,10-12H2
Definition date:	2018-04-22
Last modified:	2019-03-22
Release date:	2019-03-27
Identifier:	10-[(4-fluorophenyl)methyl]-2,3,4,10-tetrahydropyrimido[1,2-a]benzimidazole

FXB

FXB
Name:	5-propan-2-yl-4-prop-2-enoxy-7,8-dihydro-6~{H}-indeno[1,2-b]indole-9,10-dione
Formula:	C21 H21 N O3
SMILES:	CC(C)n1c2CCCC(=O)c2c3C(=O)c4cccc(OCC=C)c4c13
InChi:	InChI=1S/C21H21NO3/c1-4-11-25-16-10-5-7-13-17(16)20-19(21(13)24)18-14(22(20)12(2)3)8-6-9-15(18)23/h4-5,7,10,12H,1,6,8-9,11H2,2-3H3
Definition date:	2018-08-11
Last modified:	2019-03-22
Release date:	2019-03-27
Identifier:	5-propan-2-yl-4-prop-2-enoxy-7,8-dihydro-6~{H}-indeno[1,2-b]indole-9,10-dione

FYB

FYB
Name:	~{N}-[[4,4-bis(fluoranyl)-1-oxidanyl-cyclohexyl]methyl]-6-fluoranyl-4-oxidanylidene-chromene-2-carboxamide
Formula:	C17 H16 F3 N O4
SMILES:	C1C(F)(CCC(C1)(CNC(C=2Oc3ccc(F)cc3C(C=2)=O)=O)O)F
InChi:	InChI=1S/C17H16F3NO4/c18-10-1-2-13-11(7-10)12(22)8-14(25-13)15(23)21-9-16(24)3-5-17(19,20)6-4-16/h1-2,7-8,24H,3-6,9H2,(H,21,23)
Definition date:	2018-08-17
Last modified:	2019-03-22
Release date:	2019-03-27
Identifier:	N-[(4,4-difluoro-1-hydroxycyclohexyl)methyl]-6-fluoro-4-oxo-4H-1-benzopyran-2-carboxamide

GDW

GDW
Name:	5-[2-(diethylamino)ethyl]-7,8-dihydro-6~{H}-indeno[1,2-b]indole-9,10-dione
Formula:	C21 H24 N2 O2
SMILES:	CCN(CC)CCn1c2CCCC(=O)c2c3C(=O)c4ccccc4c13
InChi:	InChI=1S/C21H24N2O2/c1-3-22(4-2)12-13-23-16-10-7-11-17(24)18(16)19-20(23)14-8-5-6-9-15(14)21(19)25/h5-6,8-9H,3-4,7,10-13H2,1-2H3
Definition date:	2018-09-12
Last modified:	2019-03-22
Release date:	2019-03-27
Identifier:	5-[2-(diethylamino)ethyl]-7,8-dihydro-6~{H}-indeno[1,2-b]indole-9,10-dione

GZ5

GZ5
Name:	(2~{R})-2-azanyl-~{N}-[6-[(6-chloranyl-1,2,3,4-tetrahydroacridin-9-yl)amino]hexyl]-3-(1~{H}-indol-3-yl)propanamide
Formula:	C30 H36 Cl N5 O
SMILES:	N[CH](Cc1c[nH]c2ccccc12)C(=O)NCCCCCCNc3c4CCCCc4nc5cc(Cl)ccc35
InChi:	InChI=1S/C30H36ClN5O/c31-21-13-14-24-28(18-21)36-27-12-6-4-10-23(27)29(24)33-15-7-1-2-8-16-34-30(37)25(32)17-20-19-35-26-11-5-3-9-22(20)26/h3,5,9,11,13-14,18-19,25,35H,1-2,4,6-8,10,12,15-17,32H2,(H,33,36)(H,34,37)/t25-/m1/s1
Definition date:	2018-10-26
Last modified:	2019-03-22
Release date:	2019-03-27
Identifier:	(2~{R})-2-azanyl-~{N}-[6-[(6-chloranyl-1,2,3,4-tetrahydroacridin-9-yl)amino]hexyl]-3-(1~{H}-indol-3-yl)propanamide

H04

H04
Name:	1-(2-ethoxyphenyl)piperazine
Formula:	C12 H18 N2 O
SMILES:	N1(CCNCC1)c2ccccc2OCC
InChi:	InChI=1S/C12H18N2O/c1-2-15-12-6-4-3-5-11(12)14-9-7-13-8-10-14/h3-6,13H,2,7-10H2,1H3
Definition date:	2018-06-08
Last modified:	2019-03-22
Release date:	2019-03-27
Identifier:	1-(2-ethoxyphenyl)piperazine

H0D

H0D
Name:	N-(4-chlorophenyl)-N'-[(2R)-1-hydroxybutan-2-yl]urea
Formula:	C11 H15 Cl N2 O2
SMILES:	N(C(CO)CC)C(=O)Nc1ccc(cc1)Cl
InChi:	InChI=1S/C11H15ClN2O2/c1-2-9(7-15)13-11(16)14-10-5-3-8(12)4-6-10/h3-6,9,15H,2,7H2,1H3,(H2,13,14,16)/t9-/m1/s1
Definition date:	2018-06-08
Last modified:	2019-03-22
Release date:	2019-03-27
Identifier:	N-(4-chlorophenyl)-N'-[(2R)-1-hydroxybutan-2-yl]urea

H0G

H0G
Name:	2-(3-methylphenyl)-N-(1,2-oxazol-3-yl)acetamide
Formula:	C12 H12 N2 O2
SMILES:	N(C(Cc1cccc(C)c1)=O)c2ccon2
InChi:	InChI=1S/C12H12N2O2/c1-9-3-2-4-10(7-9)8-12(15)13-11-5-6-16-14-11/h2-7H,8H2,1H3,(H,13,14,15)
Definition date:	2018-06-08
Last modified:	2019-03-22
Release date:	2019-03-27
Identifier:	2-(3-methylphenyl)-N-(1,2-oxazol-3-yl)acetamide

H0J

H0J
Name:	5-(pyridin-2-yl)thiophene-2-carbothioamide
Formula:	C10 H8 N2 S2
SMILES:	n2c(c1sc(cc1)C(=S)N)cccc2
InChi:	InChI=1S/C10H8N2S2/c11-10(13)9-5-4-8(14-9)7-3-1-2-6-12-7/h1-6H,(H2,11,13)
Definition date:	2018-06-08
Last modified:	2019-03-22
Release date:	2019-03-27
Identifier:	5-(pyridin-2-yl)thiophene-2-carbothioamide

H0M

H0M
Name:	2-(3-hydroxyphenyl)-N-(pyridin-2-yl)acetamide
Formula:	C13 H12 N2 O2
SMILES:	N(C(Cc1cc(ccc1)O)=O)c2ccccn2
InChi:	InChI=1S/C13H12N2O2/c16-11-5-3-4-10(8-11)9-13(17)15-12-6-1-2-7-14-12/h1-8,16H,9H2,(H,14,15,17)
Definition date:	2018-06-08
Last modified:	2019-03-22
Release date:	2019-03-27
Identifier:	2-(3-hydroxyphenyl)-N-(pyridin-2-yl)acetamide

H0P

H0P
Name:	2-(3-hydroxyphenyl)-N-(pyridin-3-yl)acetamide
Formula:	C13 H12 N2 O2
SMILES:	N(C(Cc1cc(ccc1)O)=O)c2cccnc2
InChi:	InChI=1S/C13H12N2O2/c16-12-5-1-3-10(7-12)8-13(17)15-11-4-2-6-14-9-11/h1-7,9,16H,8H2,(H,15,17)
Definition date:	2018-06-08
Last modified:	2019-03-22
Release date:	2019-03-27
Identifier:	2-(3-hydroxyphenyl)-N-(pyridin-3-yl)acetamide

H0S

H0S
Name:	N-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
Formula:	C12 H11 N5
SMILES:	N(c1ncnc2nncc12)c3ccc(cc3)C
InChi:	InChI=1S/C12H11N5/c1-8-2-4-9(5-3-8)16-11-10-6-15-17-12(10)14-7-13-11/h2-7H,1H3,(H2,13,14,15,16,17)
Definition date:	2018-06-08
Last modified:	2019-03-22
Release date:	2019-03-27
Identifier:	N-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine

H17

H17
Name:	2-{3-[(2R)-1-acryloylpyrrolidin-2-yl]phenyl}-N-(3-chlorophenyl)acetamide
Formula:	C21 H21 Cl N2 O2
SMILES:	N(C(Cc2cccc(C1CCCN1C(=O)[C@H]=C)c2)=O)c3cccc(c3)Cl
InChi:	InChI=1S/C21H21ClN2O2/c1-2-21(26)24-11-5-10-19(24)16-7-3-6-15(12-16)13-20(25)23-18-9-4-8-17(22)14-18/h2-4,6-9,12,14,19H,1,5,10-11,13H2,(H,23,25)/t19-/m1/s1
Definition date:	2018-06-08
Last modified:	2019-03-22
Release date:	2019-03-27
Identifier:	2-{3-[(2R)-1-acryloylpyrrolidin-2-yl]phenyl}-N-(3-chlorophenyl)acetamide

H1A

H1A
Name:	2-ethyl-N-(2-hydroxyphenyl)butanamide
Formula:	C12 H17 N O2
SMILES:	N(C(C(CC)CC)=O)c1c(cccc1)O
InChi:	InChI=1S/C12H17NO2/c1-3-9(4-2)12(15)13-10-7-5-6-8-11(10)14/h5-9,14H,3-4H2,1-2H3,(H,13,15)
Definition date:	2018-06-08
Last modified:	2019-03-22
Release date:	2019-03-27
Identifier:	2-ethyl-N-(2-hydroxyphenyl)butanamide

H1G

H1G
Name:	2-(4-methoxyphenyl)-N-{5-[2-oxo-2-(3-oxopiperazin-1-yl)ethoxy]pyridin-3-yl}acetamide
Formula:	C20 H22 N4 O5
SMILES:	n2cc(NC(Cc1ccc(cc1)OC)=O)cc(c2)OCC(=O)N3CC(NCC3)=O
InChi:	InChI=1S/C20H22N4O5/c1-28-16-4-2-14(3-5-16)8-18(25)23-15-9-17(11-21-10-15)29-13-20(27)24-7-6-22-19(26)12-24/h2-5,9-11H,6-8,12-13H2,1H3,(H,22,26)(H,23,25)
Definition date:	2018-06-08
Last modified:	2019-03-22
Release date:	2019-03-27
Identifier:	2-(4-methoxyphenyl)-N-{5-[2-oxo-2-(3-oxopiperazin-1-yl)ethoxy]pyridin-3-yl}acetamide

H1J

H1J
Name:	N-(3-chlorophenyl)-2-(4-fluorophenyl)acetamide
Formula:	C14 H11 Cl F N O
SMILES:	N(C(Cc1ccc(cc1)F)=O)c2cccc(c2)Cl
InChi:	InChI=1S/C14H11ClFNO/c15-11-2-1-3-13(9-11)17-14(18)8-10-4-6-12(16)7-5-10/h1-7,9H,8H2,(H,17,18)
Definition date:	2018-06-08
Last modified:	2019-03-22
Release date:	2019-03-27
Identifier:	N-(3-chlorophenyl)-2-(4-fluorophenyl)acetamide

H1P

H1P
Name:	1-(4'-fluoro[1,1'-biphenyl]-2-yl)-1,3-dihydro-2H-pyrrol-2-one
Formula:	C16 H12 F N O
SMILES:	c2cc(c(c1ccc(F)cc1)cc2)N3C(CC=C3)=O
InChi:	InChI=1S/C16H12FNO/c17-13-9-7-12(8-10-13)14-4-1-2-5-15(14)18-11-3-6-16(18)19/h1-5,7-11H,6H2
Definition date:	2018-06-08
Last modified:	2019-03-22
Release date:	2019-03-27
Identifier:	1-(4'-fluoro[1,1'-biphenyl]-2-yl)-1,3-dihydro-2H-pyrrol-2-one

H1Y

H1Y
Name:	N-(3-chlorophenyl)-2-phenylacetamide
Formula:	C14 H12 Cl N O
SMILES:	N(C(Cc1ccccc1)=O)c2cccc(c2)Cl
InChi:	InChI=1S/C14H12ClNO/c15-12-7-4-8-13(10-12)16-14(17)9-11-5-2-1-3-6-11/h1-8,10H,9H2,(H,16,17)
Definition date:	2018-06-11
Last modified:	2019-03-22
Release date:	2019-03-27
Identifier:	N-(3-chlorophenyl)-2-phenylacetamide

H2D

H2D
Name:	(2R)-N-(1,2-oxazol-3-yl)-2-phenylbutanamide
Formula:	C13 H14 N2 O2
SMILES:	n1occc1NC(C(c2ccccc2)CC)=O
InChi:	InChI=1S/C13H14N2O2/c1-2-11(10-6-4-3-5-7-10)13(16)14-12-8-9-17-15-12/h3-9,11H,2H2,1H3,(H,14,15,16)/t11-/m1/s1
Definition date:	2018-06-11
Last modified:	2019-03-22
Release date:	2019-03-27
Identifier:	(2R)-N-(1,2-oxazol-3-yl)-2-phenylbutanamide

H2G

H2G
Name:	(2S)-1-{[(5-methylthiophen-2-yl)methyl]amino}propan-2-ol
Formula:	C9 H15 N O S
SMILES:	N(CC(C)O)Cc1ccc(s1)C
InChi:	InChI=1S/C9H15NOS/c1-7(11)5-10-6-9-4-3-8(2)12-9/h3-4,7,10-11H,5-6H2,1-2H3/t7-/m0/s1
Definition date:	2018-06-11
Last modified:	2019-03-22
Release date:	2019-03-27
Identifier:	(2S)-1-{[(5-methylthiophen-2-yl)methyl]amino}propan-2-ol

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