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L1Q

L1Q
Name:	2,3,5,6-tetrakis(fluoranyl)-4-propyl-benzenesulfonamide
Formula:	C9 H9 F4 N O2 S
SMILES:	CCCc1c(F)c(F)c(c(F)c1F)[S](N)(=O)=O
InChi:	InChI=1S/C9H9F4NO2S/c1-2-3-4-5(10)7(12)9(17(14,15)16)8(13)6(4)11/h2-3H2,1H3,(H2,14,15,16)
Definition date:	2019-07-13
Last modified:	2020-04-10
Release date:	2020-04-15
Identifier:	2,3,5,6-tetrakis(fluoranyl)-4-propyl-benzenesulfonamide

L2K

L2K
Name:	3-[3,4-bis(fluoranyl)phenyl]-1,4,6,7-tetrahydroimidazo[2,1-c][1,2,4]triazine
Formula:	C11 H10 F2 N4
SMILES:	Fc1ccc(cc1F)C2=NNC3=NCCN3C2
InChi:	InChI=1S/C11H10F2N4/c12-8-2-1-7(5-9(8)13)10-6-17-4-3-14-11(17)16-15-10/h1-2,5H,3-4,6H2,(H,14,16)
Definition date:	2019-07-16
Last modified:	2020-04-10
Release date:	2020-04-15
Identifier:	3-[3,4-bis(fluoranyl)phenyl]-1,4,6,7-tetrahydroimidazo[2,1-c][1,2,4]triazine

L7T

L7T
Name:	2,3,4,5,6-pentafluorobenzenesulfonamide
Formula:	C6 H2 F5 N O2 S
SMILES:	N[S](=O)(=O)c1c(F)c(F)c(F)c(F)c1F
InChi:	InChI=1S/C6H2F5NO2S/c7-1-2(8)4(10)6(15(12,13)14)5(11)3(1)9/h(H2,12,13,14)
Definition date:	2019-07-26
Last modified:	2020-04-10
Release date:	2020-04-15
Identifier:	2,3,4,5,6-pentakis(fluoranyl)benzenesulfonamide

L9Z

L9Z
Name:	(1~{S},3~{S},4~{S},5~{R})-3-(aminomethyl)-3,4,5-tris(hydroxyl)cyclohexane-1-carboxylic acid
Formula:	C8 H15 N O5
SMILES:	NC[C]1(O)C[CH](C[CH](O)[CH]1O)C(O)=O
InChi:	InChI=1S/C8H15NO5/c9-3-8(14)2-4(7(12)13)1-5(10)6(8)11/h4-6,10-11,14H,1-3,9H2,(H,12,13)/t4-,5+,6-,8-/m0/s1
Definition date:	2019-08-01
Last modified:	2020-04-10
Release date:	2020-04-15
Identifier:	(1~{S},3~{S},4~{S},5~{R})-3-(aminomethyl)-3,4,5-tris(oxidanyl)cyclohexane-1-carboxylic acid

JUT

JUT
Name:	4-[3,4-bis(fluoranyl)phenyl]-1,3-thiazol-2-amine
Formula:	C9 H6 F2 N2 S
SMILES:	Nc1scc(n1)c2ccc(F)c(F)c2
InChi:	InChI=1S/C9H6F2N2S/c10-6-2-1-5(3-7(6)11)8-4-14-9(12)13-8/h1-4H,(H2,12,13)
Definition date:	2019-04-02
Last modified:	2020-04-10
Release date:	2020-04-15
Identifier:	4-[3,4-bis(fluoranyl)phenyl]-1,3-thiazol-2-amine

KBN

KBN
Name:	2-(trifluoromethyl)-9~{H}-purine-6-thiol
Formula:	C6 H3 F3 N4 S
SMILES:	FC(F)(F)c1nc(S)c2nc[nH]c2n1
InChi:	InChI=1S/C6H3F3N4S/c7-6(8,9)5-12-3-2(4(14)13-5)10-1-11-3/h1H,(H2,10,11,12,13,14)
Definition date:	2019-05-10
Last modified:	2020-04-10
Release date:	2020-04-15
Identifier:	2-(trifluoromethyl)-9~{H}-purine-6-thiol

KD8

KD8
Name:	6,7-dimethyl-2-sulfanylidene-1~{H}-pteridin-4-one
Formula:	C8 H8 N4 O S
SMILES:	Cc1nc2NC(=S)NC(=O)c2nc1C
InChi:	InChI=1S/C8H8N4OS/c1-3-4(2)10-6-5(9-3)7(13)12-8(14)11-6/h1-2H3,(H2,10,11,12,13,14)
Definition date:	2019-05-14
Last modified:	2020-04-10
Release date:	2020-04-15
Identifier:	6,7-dimethyl-2-sulfanylidene-1~{H}-pteridin-4-one

KFH

KFH
Name:	2,3,5,6-tetrakis(fluoranyl)benzenesulfonamide
Formula:	C6 H3 F4 N O2 S
SMILES:	N[S](=O)(=O)c1c(F)c(F)cc(F)c1F
InChi:	InChI=1S/C6H3F4NO2S/c7-2-1-3(8)5(10)6(4(2)9)14(11,12)13/h1H,(H2,11,12,13)
Definition date:	2019-05-20
Last modified:	2020-04-10
Release date:	2020-04-15
Identifier:	2,3,5,6-tetrakis(fluoranyl)benzenesulfonamide

KGK

KGK
Name:	2,3,5,6-tetrakis(fluoranyl)-4-methyl-benzenesulfonamide
Formula:	C7 H5 F4 N O2 S
SMILES:	Cc1c(F)c(F)c(c(F)c1F)[S](N)(=O)=O
InChi:	InChI=1S/C7H5F4NO2S/c1-2-3(8)5(10)7(15(12,13)14)6(11)4(2)9/h1H3,(H2,12,13,14)
Definition date:	2019-05-21
Last modified:	2020-04-10
Release date:	2020-04-15
Identifier:	2,3,5,6-tetrakis(fluoranyl)-4-methyl-benzenesulfonamide

KJ5

KJ5
Name:	4-ethyl-2,3,5,6-tetrakis(fluoranyl)benzenesulfonamide
Formula:	C8 H7 F4 N O2 S
SMILES:	CCc1c(F)c(F)c(c(F)c1F)[S](N)(=O)=O
InChi:	InChI=1S/C8H7F4NO2S/c1-2-3-4(9)6(11)8(16(13,14)15)7(12)5(3)10/h2H2,1H3,(H2,13,14,15)
Definition date:	2019-05-22
Last modified:	2020-04-10
Release date:	2020-04-15
Identifier:	4-ethyl-2,3,5,6-tetrakis(fluoranyl)benzenesulfonamide

CZX

CZX
Name:	4-[(1~{S})-1-(2,3-dimethylphenyl)ethyl]-1~{H}-imidazole
Formula:	C13 H16 N2
SMILES:	C[CH](c1c[nH]cn1)c2cccc(C)c2C
InChi:	InChI=1S/C13H16N2/c1-9-5-4-6-12(10(9)2)11(3)13-7-14-8-15-13/h4-8,11H,1-3H3,(H,14,15)/t11-/m0/s1
Definition date:	2019-05-24
Last modified:	2020-04-10
Release date:	2020-04-15
Identifier:	4-[(1~{S})-1-(2,3-dimethylphenyl)ethyl]-1~{H}-imidazole

D5U

D5U
Name:	2-[3-(2-methoxyphenyl)-3-oxidanylidene-propyl]benzoic acid
Formula:	C17 H16 O4
SMILES:	COc1ccccc1C(=O)CCc2ccccc2C(O)=O
InChi:	InChI=1S/C17H16O4/c1-21-16-9-5-4-8-14(16)15(18)11-10-12-6-2-3-7-13(12)17(19)20/h2-9H,10-11H2,1H3,(H,19,20)
Definition date:	2019-07-04
Last modified:	2020-04-10
Release date:	2020-04-15
Identifier:	2-[3-(2-methoxyphenyl)-3-oxidanylidene-propyl]benzoic acid

D60

D60
Name:	2-[3-[2,6-bis(fluoranyl)-4-(1~{H}-pyrazol-4-yl)phenyl]-3-oxidanylidene-propyl]-4-(1-methylpyrazol-4-yl)benzoic acid
Formula:	C23 H18 F2 N4 O3
SMILES:	Cn1cc(cn1)c2ccc(C(O)=O)c(CCC(=O)c3c(F)cc(cc3F)c4c[nH]nc4)c2
InChi:	InChI=1S/C23H18F2N4O3/c1-29-12-17(11-28-29)13-2-4-18(23(31)32)14(6-13)3-5-21(30)22-19(24)7-15(8-20(22)25)16-9-26-27-10-16/h2,4,6-12H,3,5H2,1H3,(H,26,27)(H,31,32)
Definition date:	2019-07-04
Last modified:	2020-04-10
Release date:	2020-04-15
Identifier:	2-[3-[2,6-bis(fluoranyl)-4-(1~{H}-pyrazol-4-yl)phenyl]-3-oxidanylidene-propyl]-4-(1-methylpyrazol-4-yl)benzoic acid

EH6

EH6
Name:	2-[(3-chloranyl-2-phenyl-phenyl)amino]benzoic acid
Formula:	C19 H14 Cl N O2
SMILES:	OC(=O)c1ccccc1Nc2cccc(Cl)c2c3ccccc3
InChi:	InChI=1S/C19H14ClNO2/c20-15-10-6-12-17(18(15)13-7-2-1-3-8-13)21-16-11-5-4-9-14(16)19(22)23/h1-12,21H,(H,22,23)
Definition date:	2019-12-24
Last modified:	2020-04-10
Release date:	2020-04-15
Identifier:	2-[(3-chloranyl-2-phenyl-phenyl)amino]benzoic acid

EHC

EHC
Name:	2-[[3-chloranyl-2-(2,3-dihydro-1-benzofuran-5-yl)phenyl]amino]benzoic acid
Formula:	C21 H16 Cl N O3
SMILES:	OC(=O)c1ccccc1Nc2cccc(Cl)c2c3ccc4OCCc4c3
InChi:	InChI=1S/C21H16ClNO3/c22-16-5-3-7-18(23-17-6-2-1-4-15(17)21(24)25)20(16)14-8-9-19-13(12-14)10-11-26-19/h1-9,12,23H,10-11H2,(H,24,25)
Definition date:	2019-12-24
Last modified:	2020-04-10
Release date:	2020-04-15
Identifier:	2-[[3-chloranyl-2-(2,3-dihydro-1-benzofuran-5-yl)phenyl]amino]benzoic acid

EHO

EHO
Name:	2-phenylazanylbenzoic acid
Formula:	C13 H11 N O2
SMILES:	OC(=O)c1ccccc1Nc2ccccc2
InChi:	InChI=1S/C13H11NO2/c15-13(16)11-8-4-5-9-12(11)14-10-6-2-1-3-7-10/h1-9,14H,(H,15,16)
Definition date:	2019-12-24
Last modified:	2020-04-10
Release date:	2020-04-15
Identifier:	2-phenylazanylbenzoic acid

EHR

EHR
Name:	2-[(2-phenylphenyl)amino]benzoic acid
Formula:	C19 H15 N O2
SMILES:	OC(=O)c1ccccc1Nc2ccccc2c3ccccc3
InChi:	InChI=1S/C19H15NO2/c21-19(22)16-11-5-7-13-18(16)20-17-12-6-4-10-15(17)14-8-2-1-3-9-14/h1-13,20H,(H,21,22)
Definition date:	2019-12-24
Last modified:	2020-04-10
Release date:	2020-04-15
Identifier:	2-[(2-phenylphenyl)amino]benzoic acid

EHU

EHU
Name:	2-[[3-chloranyl-4-(methylamino)-2-phenyl-phenyl]amino]benzoic acid
Formula:	C20 H17 Cl N2 O2
SMILES:	CNc1ccc(Nc2ccccc2C(O)=O)c(c1Cl)c3ccccc3
InChi:	InChI=1S/C20H17ClN2O2/c1-22-17-12-11-16(18(19(17)21)13-7-3-2-4-8-13)23-15-10-6-5-9-14(15)20(24)25/h2-12,22-23H,1H3,(H,24,25)
Definition date:	2019-12-24
Last modified:	2020-04-10
Release date:	2020-04-15
Identifier:	2-[[3-chloranyl-4-(methylamino)-2-phenyl-phenyl]amino]benzoic acid

KMQ

KMQ
Name:	[[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl] [(2~{R},3~{R},4~{R},5~{S})-4-[(~{E})-but-2-enoxy]-3,5-bis(oxidanyl)oxolan-2-yl]methyl hydrogen phosphate
Formula:	C19 H29 N5 O14 P2
SMILES:	CC=CCO[CH]1[CH](O)O[CH](CO[P](O)(=O)O[P](O)(=O)OC[CH]2O[CH]([CH](O)[CH]2O)n3cnc4c(N)ncnc34)[CH]1O
InChi:	InChI=1S/C19H29N5O14P2/c1-2-3-4-33-15-13(26)10(37-19(15)28)6-35-40(31,32)38-39(29,30)34-5-9-12(25)14(27)18(36-9)24-8-23-11-16(20)21-7-22-17(11)24/h2-3,7-10,12-15,18-19,25-28H,4-6H2,1H3,(H,29,30)(H,31,32)(H2,20,21,22)/b3-2+/t9-,10-,12-,13-,14-,15-,18-,19+/m1/s1
Definition date:	2019-06-08
Last modified:	2020-04-10
Release date:	2020-04-15
Identifier:	[[(2~{R},3~{S},4~{R},5~{R})-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl] [(2~{R},3~{R},4~{R},5~{S})-4-[(~{E})-but-2-enoxy]-3,5-bis(oxidanyl)oxolan-2-yl]methyl hydrogen phosphate

OS8

OS8
Name:	(4~{R})-~{N}-[3-(7-methoxy-3,4-dihydro-2~{H}-quinolin-1-yl)propyl]-4-methyl-2-oxidanylidene-1,3,4,5-tetrahydro-1,5-benzodiazepine-6-carboxamide
Formula:	C24 H30 N4 O3
SMILES:	COc1ccc2CCCN(CCCNC(=O)c3cccc4NC(=O)C[CH](C)Nc34)c2c1
InChi:	InChI=1S/C24H30N4O3/c1-16-14-22(29)27-20-8-3-7-19(23(20)26-16)24(30)25-11-5-13-28-12-4-6-17-9-10-18(31-2)15-21(17)28/h3,7-10,15-16,26H,4-6,11-14H2,1-2H3,(H,25,30)(H,27,29)/t16-/m1/s1
Definition date:	2020-04-01
Last modified:	2020-04-10
Release date:	2020-04-15
Identifier:	(4~{R})-~{N}-[3-(7-methoxy-3,4-dihydro-2~{H}-quinolin-1-yl)propyl]-4-methyl-2-oxidanylidene-1,3,4,5-tetrahydro-1,5-benzodiazepine-6-carboxamide

OSN

OSN
Name:	(4~{R})-6-[(~{E})-5-(7-methoxy-3,4-dihydro-2~{H}-quinolin-1-yl)pent-1-enyl]-4-methyl-1,3,4,5-tetrahydro-1,5-benzodiazepin-2-one
Formula:	C25 H31 N3 O2
SMILES:	COc1ccc2CCCN(CCCC=Cc3cccc4NC(=O)C[CH](C)Nc34)c2c1
InChi:	InChI=1S/C25H31N3O2/c1-18-16-24(29)27-22-11-6-9-20(25(22)26-18)8-4-3-5-14-28-15-7-10-19-12-13-21(30-2)17-23(19)28/h4,6,8-9,11-13,17-18,26H,3,5,7,10,14-16H2,1-2H3,(H,27,29)/b8-4+/t18-/m1/s1
Definition date:	2020-04-01
Last modified:	2020-04-10
Release date:	2020-04-15
Identifier:	(4~{R})-6-[(~{E})-5-(7-methoxy-3,4-dihydro-2~{H}-quinolin-1-yl)pent-1-enyl]-4-methyl-1,3,4,5-tetrahydro-1,5-benzodiazepin-2-one

OSQ

OSQ
Name:	(3~{R})-~{N}-[3-(3,4-dihydro-2~{H}-quinolin-1-yl)-2,2-bis(fluoranyl)propyl]-3-methyl-2-oxidanylidene-3,4-dihydro-1~{H}-quinoxaline-5-carboxamide
Formula:	C22 H24 F2 N4 O2
SMILES:	C[CH]1Nc2c(NC1=O)cccc2C(=O)NCC(F)(F)CN3CCCc4ccccc34
InChi:	InChI=1S/C22H24F2N4O2/c1-14-20(29)27-17-9-4-8-16(19(17)26-14)21(30)25-12-22(23,24)13-28-11-5-7-15-6-2-3-10-18(15)28/h2-4,6,8-10,14,26H,5,7,11-13H2,1H3,(H,25,30)(H,27,29)/t14-/m1/s1
Definition date:	2020-04-01
Last modified:	2020-04-10
Release date:	2020-04-15
Identifier:	(3~{R})-~{N}-[3-(3,4-dihydro-2~{H}-quinolin-1-yl)-2,2-bis(fluoranyl)propyl]-3-methyl-2-oxidanylidene-3,4-dihydro-1~{H}-quinoxaline-5-carboxamide

OU2

OU2
Name:	5-azanyl-~{N}-[[4-[[(2~{S})-4-cyclohexyl-1-(ethylamino)-1-oxidanylidene-butan-2-yl]carbamoyl]phenyl]methyl]-1-phenyl-pyrazole-4-carboxamide
Formula:	C30 H38 N6 O3
SMILES:	CCNC(=O)[CH](CCC1CCCCC1)NC(=O)c2ccc(CNC(=O)c3cnn(c3N)c4ccccc4)cc2
InChi:	InChI=1S/C30H38N6O3/c1-2-32-30(39)26(18-15-21-9-5-3-6-10-21)35-28(37)23-16-13-22(14-17-23)19-33-29(38)25-20-34-36(27(25)31)24-11-7-4-8-12-24/h4,7-8,11-14,16-17,20-21,26H,2-3,5-6,9-10,15,18-19,31H2,1H3,(H,32,39)(H,33,38)(H,35,37)/t26-/m0/s1
Definition date:	2020-04-05
Last modified:	2020-04-10
Release date:	2020-04-15
Identifier:	5-azanyl-~{N}-[[4-[[(2~{S})-4-cyclohexyl-1-(ethylamino)-1-oxidanylidene-butan-2-yl]carbamoyl]phenyl]methyl]-1-phenyl-pyrazole-4-carboxamide

M0J

M0J
Name:	N-[(2S)-2-hydroxypropyl]-N'-phenylurea
Formula:	C10 H14 N2 O2
SMILES:	N(C(=O)NCC(O)C)c1ccccc1
InChi:	InChI=1S/C10H14N2O2/c1-8(13)7-11-10(14)12-9-5-3-2-4-6-9/h2-6,8,13H,7H2,1H3,(H2,11,12,14)/t8-/m0/s1
Definition date:	2019-03-15
Last modified:	2020-04-10
Release date:	2020-04-15
Identifier:	N-[(2S)-2-hydroxypropyl]-N'-phenylurea

M4H

M4H
Name:	5-oxidanyl-4-oxidanylidene-1-[(1-pyrrolo[2,3-b]pyridin-1-ylcyclopentyl)methyl]pyridine-3-carboxylic acid
Formula:	C19 H19 N3 O4
SMILES:	OC(=O)C1=CN(CC2(CCCC2)n3ccc4cccnc34)C=C(O)C1=O
InChi:	InChI=1S/C19H19N3O4/c23-15-11-21(10-14(16(15)24)18(25)26)12-19(6-1-2-7-19)22-9-5-13-4-3-8-20-17(13)22/h3-5,8-11,23H,1-2,6-7,12H2,(H,25,26)
Definition date:	2019-10-03
Last modified:	2020-04-10
Release date:	2020-04-15
Identifier:	5-oxidanyl-4-oxidanylidene-1-[(1-pyrrolo[2,3-b]pyridin-1-ylcyclopentyl)methyl]pyridine-3-carboxylic acid

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