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W0R

W0R
Name:	3-[(2-methylpropyl)sulfanyl]-N-(pyridin-3-yl)propanamide
Formula:	C12 H18 N2 O S
SMILES:	O=C(Nc1cccnc1)CCSCC(C)C
InChi:	InChI=1S/C12H18N2OS/c1-10(2)9-16-7-5-12(15)14-11-4-3-6-13-8-11/h3-4,6,8,10H,5,7,9H2,1-2H3,(H,14,15)
Definition date:	2022-09-02
Last modified:	2022-10-28
Release date:	2022-11-02
Identifier:	3-[(2-methylpropyl)sulfanyl]-N-(pyridin-3-yl)propanamide

W2O

W2O
Name:	D-phenylalaninamide
Formula:	C9 H12 N2 O
SMILES:	NC(Cc1ccccc1)C(N)=O
InChi:	InChI=1S/C9H12N2O/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8H,6,10H2,(H2,11,12)/t8-/m1/s1
Definition date:	2022-09-02
Last modified:	2022-10-28
Release date:	2022-11-02
Identifier:	D-phenylalaninamide

W0X

W0X
Name:	3-[(3-bromophenyl)methanesulfonyl]propanoic acid
Formula:	C10 H11 Br O4 S
SMILES:	Brc1cc(CS(=O)(=O)CCC(=O)O)ccc1
InChi:	InChI=1S/C10H11BrO4S/c11-9-3-1-2-8(6-9)7-16(14,15)5-4-10(12)13/h1-3,6H,4-5,7H2,(H,12,13)
Definition date:	2022-09-02
Last modified:	2022-10-28
Release date:	2022-11-02
Identifier:	3-[(3-bromophenyl)methanesulfonyl]propanoic acid

W18

W18
Name:	4-amino-N-[(2R)-1-hydroxybutan-2-yl]benzamide
Formula:	C11 H16 N2 O2
SMILES:	O=C(NC(CC)CO)c1ccc(N)cc1
InChi:	InChI=1S/C11H16N2O2/c1-2-10(7-14)13-11(15)8-3-5-9(12)6-4-8/h3-6,10,14H,2,7,12H2,1H3,(H,13,15)/t10-/m1/s1
Definition date:	2022-09-02
Last modified:	2022-10-28
Release date:	2022-11-02
Identifier:	4-amino-N-[(2R)-1-hydroxybutan-2-yl]benzamide

W36

W36
Name:	2-amino-N-(3-fluoro-4-methylphenyl)ethane-1-sulfonamide
Formula:	C9 H13 F N2 O2 S
SMILES:	O=S(=O)(Nc1ccc(C)c(F)c1)CCN
InChi:	InChI=1S/C9H13FN2O2S/c1-7-2-3-8(6-9(7)10)12-15(13,14)5-4-11/h2-3,6,12H,4-5,11H2,1H3
Definition date:	2022-09-02
Last modified:	2022-10-28
Release date:	2022-11-02
Identifier:	2-amino-N-(3-fluoro-4-methylphenyl)ethane-1-sulfonamide

W1E

W1E
Name:	2-methylpropyl [(3R)-1,1-dioxo-2,3-dihydro-1H-1lambda~6~-thiophen-3-yl]acetate
Formula:	C10 H16 O4 S
SMILES:	O=S1(=O)C=CC(CC(=O)OCC(C)C)C1
InChi:	InChI=1S/C10H16O4S/c1-8(2)6-14-10(11)5-9-3-4-15(12,13)7-9/h3-4,8-9H,5-7H2,1-2H3/t9-/m0/s1
Definition date:	2022-09-02
Last modified:	2022-10-28
Release date:	2022-11-02
Identifier:	2-methylpropyl [(3R)-1,1-dioxo-2,3-dihydro-1H-1lambda~6~-thiophen-3-yl]acetate

W1I

W1I
Name:	N'-(2-bromophenyl)-N,N-dimethylsulfuric diamide
Formula:	C8 H11 Br N2 O2 S
SMILES:	Brc1ccccc1NS(=O)(=O)N(C)C
InChi:	InChI=1S/C8H11BrN2O2S/c1-11(2)14(12,13)10-8-6-4-3-5-7(8)9/h3-6,10H,1-2H3
Definition date:	2022-09-02
Last modified:	2022-10-28
Release date:	2022-11-02
Identifier:	N'-(2-bromophenyl)-N,N-dimethylsulfuric diamide

W3H

W3H
Name:	(3R)-3-(4-chlorobenzene-1-sulfonyl)butanoic acid
Formula:	C10 H11 Cl O4 S
SMILES:	O=S(=O)(c1ccc(Cl)cc1)C(C)CC(=O)O
InChi:	InChI=1S/C10H11ClO4S/c1-7(6-10(12)13)16(14,15)9-4-2-8(11)3-5-9/h2-5,7H,6H2,1H3,(H,12,13)/t7-/m1/s1
Definition date:	2022-09-02
Last modified:	2022-10-28
Release date:	2022-11-02
Identifier:	(3R)-3-(4-chlorobenzene-1-sulfonyl)butanoic acid

W1N

W1N
Name:	(3S)-3-amino-4-(2-fluorophenyl)butanoic acid
Formula:	C10 H12 F N O2
SMILES:	Fc1ccccc1CC(N)CC(=O)O
InChi:	InChI=1S/C10H12FNO2/c11-9-4-2-1-3-7(9)5-8(12)6-10(13)14/h1-4,8H,5-6,12H2,(H,13,14)/t8-/m0/s1
Definition date:	2022-09-02
Last modified:	2022-10-28
Release date:	2022-11-02
Identifier:	(3S)-3-amino-4-(2-fluorophenyl)butanoic acid

UTE

UTE
Name:	4-[2,4-bis(oxidanylidene)-6-(trifluoromethyl)-1H-pyrimidin-3-yl]-5-methyl-2-(2-methylphenoxy)benzenecarbonitrile
Formula:	C20 H14 F3 N3 O3
SMILES:	Cc1ccccc1Oc2cc(N3C(=O)NC(=CC3=O)C(F)(F)F)c(C)cc2C#N
InChi:	InChI=1S/C20H14F3N3O3/c1-11-5-3-4-6-15(11)29-16-8-14(12(2)7-13(16)10-24)26-18(27)9-17(20(21,22)23)25-19(26)28/h3-9H,1-2H3,(H,25,28)
Synonyms:	4-[2,4-bis(oxidanylidene)-6-(trifluoromethyl)-1~{H}-pyrimidin-3-yl]-5-methyl-2-(2-methylphenoxy)benzenecarbonitrile
Definition date:	2021-03-17
Last modified:	2022-10-28
Release date:	2022-11-02
Identifier:	4-[2,4-bis(oxidanylidene)-6-(trifluoromethyl)-1~{H}-pyrimidin-3-yl]-5-methyl-2-(2-methylphenoxy)benzenecarbonitrile

W3Q

W3Q
Name:	N-[(2-methoxyphenyl)methyl]urea
Formula:	C9 H12 N2 O2
SMILES:	COc1ccccc1CNC(N)=O
InChi:	InChI=1S/C9H12N2O2/c1-13-8-5-3-2-4-7(8)6-11-9(10)12/h2-5H,6H2,1H3,(H3,10,11,12)
Definition date:	2022-09-02
Last modified:	2022-10-28
Release date:	2022-11-02
Identifier:	N-[(2-methoxyphenyl)methyl]urea

R7X

R7X
Name:	1-[(3-acetylphenyl)acetyl]-N-(6-bromopyridin-2-yl)-L-prolinamide
Formula:	C20 H20 Br N3 O3
SMILES:	O=C(Nc1cccc(Br)n1)C1CCCN1C(=O)Cc1cccc(c1)C(C)=O
InChi:	InChI=1S/C20H20BrN3O3/c1-13(25)15-6-2-5-14(11-15)12-19(26)24-10-4-7-16(24)20(27)23-18-9-3-8-17(21)22-18/h2-3,5-6,8-9,11,16H,4,7,10,12H2,1H3,(H,22,23,27)/t16-/m0/s1
Definition date:	2022-06-22
Last modified:	2022-10-28
Release date:	2022-11-02
Identifier:	1-[(3-acetylphenyl)acetyl]-N-(6-bromopyridin-2-yl)-L-prolinamide

W1W

W1W
Name:	6-[(pyridin-2-yl)sulfanyl]pyridin-3-amine
Formula:	C10 H9 N3 S
SMILES:	Nc1cnc(Sc2ncccc2)cc1
InChi:	InChI=1S/C10H9N3S/c11-8-4-5-10(13-7-8)14-9-3-1-2-6-12-9/h1-7H,11H2
Definition date:	2022-09-02
Last modified:	2022-10-28
Release date:	2022-11-02
Identifier:	6-[(pyridin-2-yl)sulfanyl]pyridin-3-amine

W3U

W3U
Name:	1-benzyl-1H-pyrazole-4-carboxylic acid
Formula:	C11 H10 N2 O2
SMILES:	O=C(O)c1cn(Cc2ccccc2)nc1
InChi:	InChI=1S/C11H10N2O2/c14-11(15)10-6-12-13(8-10)7-9-4-2-1-3-5-9/h1-6,8H,7H2,(H,14,15)
Definition date:	2022-09-02
Last modified:	2022-10-28
Release date:	2022-11-02
Identifier:	1-benzyl-1H-pyrazole-4-carboxylic acid

UTK

UTK
Name:	4-[2,4-bis(oxidanylidene)-6-(trifluoromethyl)-1H-pyrimidin-3-yl]-5-fluoranyl-2-(2-methylphenoxy)benzenecarbonitrile
Formula:	C19 H11 F4 N3 O3
SMILES:	Cc1ccccc1Oc2cc(N3C(=O)NC(=CC3=O)C(F)(F)F)c(F)cc2C#N
InChi:	InChI=1S/C19H11F4N3O3/c1-10-4-2-3-5-14(10)29-15-7-13(12(20)6-11(15)9-24)26-17(27)8-16(19(21,22)23)25-18(26)28/h2-8H,1H3,(H,25,28)
Synonyms:	4-[2,4-bis(oxidanylidene)-6-(trifluoromethyl)-1~{H}-pyrimidin-3-yl]-5-fluoranyl-2-(2-methylphenoxy)benzenecarbonitrile
Definition date:	2021-03-17
Last modified:	2022-10-28
Release date:	2022-11-02
Identifier:	4-[2,4-bis(oxidanylidene)-6-(trifluoromethyl)-1~{H}-pyrimidin-3-yl]-5-fluoranyl-2-(2-methylphenoxy)benzenecarbonitrile

W3Z

W3Z
Name:	ethyl (3S)-1-(methanesulfonyl)piperidine-3-carboxylate
Formula:	C9 H17 N O4 S
SMILES:	O=S(C)(=O)N1CCCC(C1)C(=O)OCC
InChi:	InChI=1S/C9H17NO4S/c1-3-14-9(11)8-5-4-6-10(7-8)15(2,12)13/h8H,3-7H2,1-2H3/t8-/m0/s1
Definition date:	2022-09-02
Last modified:	2022-10-28
Release date:	2022-11-02
Identifier:	ethyl (3S)-1-(methanesulfonyl)piperidine-3-carboxylate

UTN

UTN
Name:	4-[2,4-bis(oxidanylidene)-6-(trifluoromethyl)-1H-pyrimidin-3-yl]-5-methoxy-2-(2-methylphenoxy)benzenecarbonitrile
Formula:	C20 H14 F3 N3 O4
SMILES:	COc1cc(C#N)c(Oc2ccccc2C)cc1N3C(=O)NC(=CC3=O)C(F)(F)F
InChi:	InChI=1S/C20H14F3N3O4/c1-11-5-3-4-6-14(11)30-15-8-13(16(29-2)7-12(15)10-24)26-18(27)9-17(20(21,22)23)25-19(26)28/h3-9H,1-2H3,(H,25,28)
Synonyms:	4-[2,4-bis(oxidanylidene)-6-(trifluoromethyl)-1~{H}-pyrimidin-3-yl]-5-methoxy-2-(2-methylphenoxy)benzenecarbonitrile
Definition date:	2021-03-17
Last modified:	2022-10-28
Release date:	2022-11-02
Identifier:	4-[2,4-bis(oxidanylidene)-6-(trifluoromethyl)-1~{H}-pyrimidin-3-yl]-5-methoxy-2-(2-methylphenoxy)benzenecarbonitrile

W25

W25
Name:	(2R)-(3,4-difluorophenyl)(hydroxy)acetic acid
Formula:	C8 H6 F2 O3
SMILES:	Fc1ccc(cc1F)C(O)C(=O)O
InChi:	InChI=1S/C8H6F2O3/c9-5-2-1-4(3-6(5)10)7(11)8(12)13/h1-3,7,11H,(H,12,13)/t7-/m1/s1
Definition date:	2022-09-02
Last modified:	2022-10-28
Release date:	2022-11-02
Identifier:	(2R)-(3,4-difluorophenyl)(hydroxy)acetic acid

UTQ

UTQ
Name:	3-(5-chloranyl-2,4-dimethoxy-phenyl)-6-(trifluoromethyl)-1H-pyrimidine-2,4-dione
Formula:	C13 H10 Cl F3 N2 O4
SMILES:	COc1cc(OC)c(cc1Cl)N2C(=O)NC(=CC2=O)C(F)(F)F
InChi:	InChI=1S/C13H10ClF3N2O4/c1-22-8-4-9(23-2)7(3-6(8)14)19-11(20)5-10(13(15,16)17)18-12(19)21/h3-5H,1-2H3,(H,18,21)
Synonyms:	3-(5-chloranyl-2,4-dimethoxy-phenyl)-6-(trifluoromethyl)-1~{H}-pyrimidine-2,4-dione
Definition date:	2021-03-17
Last modified:	2022-10-28
Release date:	2022-11-02
Identifier:	3-(5-chloranyl-2,4-dimethoxy-phenyl)-6-(trifluoromethyl)-1~{H}-pyrimidine-2,4-dione

UTT

UTT
Name:	2-[[4-chloranyl-2,6-bis(fluoranyl)phenyl]methylamino]-7-oxidanylidene-5-propyl-4H-pyrazolo[1,5-a]pyrimidine-3-carbonitrile
Formula:	C17 H14 Cl F2 N5 O
SMILES:	CCCC1=CC(=O)n2nc(NCc3c(F)cc(Cl)cc3F)c(C#N)c2N1
InChi:	InChI=1S/C17H14ClF2N5O/c1-2-3-10-6-15(26)25-17(23-10)11(7-21)16(24-25)22-8-12-13(19)4-9(18)5-14(12)20/h4-6,23H,2-3,8H2,1H3,(H,22,24)
Synonyms:	2-[[4-chloranyl-2,6-bis(fluoranyl)phenyl]methylamino]-7-oxidanylidene-5-propyl-4~{H}-pyrazolo[1,5-a]pyrimidine-3-carbonitrile
Definition date:	2021-03-17
Last modified:	2022-10-28
Release date:	2022-11-02
Identifier:	2-[[4-chloranyl-2,6-bis(fluoranyl)phenyl]methylamino]-7-oxidanylidene-5-propyl-4~{H}-pyrazolo[1,5-a]pyrimidine-3-carbonitrile

W2B

W2B
Name:	N-cyclohexyl-2-(1H-pyrazol-1-yl)acetamide
Formula:	C11 H17 N3 O
SMILES:	O=C(NC1CCCCC1)Cn1cccn1
InChi:	InChI=1S/C11H17N3O/c15-11(9-14-8-4-7-12-14)13-10-5-2-1-3-6-10/h4,7-8,10H,1-3,5-6,9H2,(H,13,15)
Definition date:	2022-09-02
Last modified:	2022-10-28
Release date:	2022-11-02
Identifier:	N-cyclohexyl-2-(1H-pyrazol-1-yl)acetamide

UU2

UU2
Name:	4-[6-[bis(fluoranyl)-phenyl-methyl]-2,4-bis(oxidanylidene)-1~{H}-pyrimidin-3-yl]-5-fluoranyl-2-(2-methylphenoxy)benzenecarbonitrile
Formula:	C25 H16 F3 N3 O3
SMILES:	Cc1ccccc1Oc2cc(N3C(=O)NC(=CC3=O)C(F)(F)c4ccccc4)c(F)cc2C#N
InChi:	InChI=1S/C25H16F3N3O3/c1-15-7-5-6-10-20(15)34-21-12-19(18(26)11-16(21)14-29)31-23(32)13-22(30-24(31)33)25(27,28)17-8-3-2-4-9-17/h2-13H,1H3,(H,30,33)
Synonyms:	4-[6-[bis(fluoranyl)-phenyl-methyl]-2,4-bis(oxidanylidene)-1H-pyrimidin-3-yl]-5-fluoranyl-2-(2-methylphenoxy)benzenecarbonitrile
Definition date:	2021-03-19
Last modified:	2022-10-28
Release date:	2022-11-02
Identifier:	4-[6-[bis(fluoranyl)-phenyl-methyl]-2,4-bis(oxidanylidene)-1~{H}-pyrimidin-3-yl]-5-fluoranyl-2-(2-methylphenoxy)benzenecarbonitrile

UU8

UU8
Name:	4-[2,4-bis(oxidanylidene)-6-(phenylsulfonyl)-1H-pyrimidin-3-yl]-5-fluoranyl-2-(2-methylphenoxy)benzenecarbonitrile
Formula:	C24 H16 F N3 O5 S
SMILES:	Cc1ccccc1Oc2cc(N3C(=O)NC(=CC3=O)[S](=O)(=O)c4ccccc4)c(F)cc2C#N
InChi:	InChI=1S/C24H16FN3O5S/c1-15-7-5-6-10-20(15)33-21-12-19(18(25)11-16(21)14-26)28-23(29)13-22(27-24(28)30)34(31,32)17-8-3-2-4-9-17/h2-13H,1H3,(H,27,30)
Synonyms:	4-[2,4-bis(oxidanylidene)-6-(phenylsulfonyl)-1~{H}-pyrimidin-3-yl]-5-fluoranyl-2-(2-methylphenoxy)benzenecarbonitrile
Definition date:	2021-03-19
Last modified:	2022-10-28
Release date:	2022-11-02
Identifier:	4-[2,4-bis(oxidanylidene)-6-(phenylsulfonyl)-1~{H}-pyrimidin-3-yl]-5-fluoranyl-2-(2-methylphenoxy)benzenecarbonitrile

W4H

W4H
Name:	N-[(1S)-1-cyanopropyl]benzamide
Formula:	C11 H12 N2 O
SMILES:	O=C(NC(C#N)CC)c1ccccc1
InChi:	InChI=1S/C11H12N2O/c1-2-10(8-12)13-11(14)9-6-4-3-5-7-9/h3-7,10H,2H2,1H3,(H,13,14)/t10-/m0/s1
Definition date:	2022-09-02
Last modified:	2022-10-28
Release date:	2022-11-02
Identifier:	N-[(1S)-1-cyanopropyl]benzamide

W4L

W4L
Name:	N~2~-[(6-chloropyridin-3-yl)methyl]-N,N~2~-diethylglycinamide
Formula:	C12 H18 Cl N3 O
SMILES:	Clc1ccc(CN(CC)CC(=O)NCC)cn1
InChi:	InChI=1S/C12H18ClN3O/c1-3-14-12(17)9-16(4-2)8-10-5-6-11(13)15-7-10/h5-7H,3-4,8-9H2,1-2H3,(H,14,17)
Definition date:	2022-09-02
Last modified:	2022-10-28
Release date:	2022-11-02
Identifier:	N~2~-[(6-chloropyridin-3-yl)methyl]-N,N~2~-diethylglycinamide

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