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UV5

UV5
Name:	3-[2,6-bis(oxidanylidene)-4-(trifluoromethyl)-5~{H}-pyrimidin-1-yl]-~{N}-methyl-2-pyridin-2-yl-imidazo[1,2-a]pyridine-7-carboxamide
Formula:	C19 H13 F3 N6 O3
SMILES:	CNC(=O)c1ccn2c(c1)nc(c3ccccn3)c2N4C(=O)CC(=NC4=O)C(F)(F)F
InChi:	InChI=1S/C19H13F3N6O3/c1-23-16(30)10-5-7-27-13(8-10)26-15(11-4-2-3-6-24-11)17(27)28-14(29)9-12(19(20,21)22)25-18(28)31/h2-8H,9H2,1H3,(H,23,30)
Definition date:	2021-03-22
Last modified:	2022-10-28
Release date:	2022-11-02
Identifier:	3-[2,6-bis(oxidanylidene)-4-(trifluoromethyl)-5~{H}-pyrimidin-1-yl]-~{N}-methyl-2-pyridin-2-yl-imidazo[1,2-a]pyridine-7-carboxamide

VBI

VBI
Name:	N~2~-(3-chlorophenyl)-N~2~-(methanesulfonyl)-N-methylglycinamide
Formula:	C10 H13 Cl N2 O3 S
SMILES:	Clc1cc(ccc1)N(CC(=O)NC)S(C)(=O)=O
InChi:	InChI=1S/C10H13ClN2O3S/c1-12-10(14)7-13(17(2,15)16)9-5-3-4-8(11)6-9/h3-6H,7H2,1-2H3,(H,12,14)
Definition date:	2022-08-29
Last modified:	2022-10-28
Release date:	2022-11-02
Identifier:	N~2~-(3-chlorophenyl)-N~2~-(methanesulfonyl)-N-methylglycinamide

VQL

VQL
Name:	(6P)-4-(methylsulfanyl)-6-(2-methyl-1,3-thiazol-4-yl)-1,3,5-triazin-2-amine
Formula:	C8 H9 N5 S2
SMILES:	Cc1nc(cs1)c1nc(SC)nc(N)n1
InChi:	InChI=1S/C8H9N5S2/c1-4-10-5(3-15-4)6-11-7(9)13-8(12-6)14-2/h3H,1-2H3,(H2,9,11,12,13)
Definition date:	2022-09-02
Last modified:	2022-10-28
Release date:	2022-11-02
Identifier:	(6P)-4-(methylsulfanyl)-6-(2-methyl-1,3-thiazol-4-yl)-1,3,5-triazin-2-amine

VBO

VBO
Name:	methyl 3-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)propanoate
Formula:	C8 H10 N2 O4
SMILES:	O=C(CCN1C=CC(=O)NC1=O)OC
InChi:	InChI=1S/C8H10N2O4/c1-14-7(12)3-5-10-4-2-6(11)9-8(10)13/h2,4H,3,5H2,1H3,(H,9,11,13)
Definition date:	2022-08-29
Last modified:	2022-10-28
Release date:	2022-11-02
Identifier:	methyl 3-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)propanoate

W7X

W7X
Name:	1-(6-methylpyridin-2-yl)-1,4-diazepane
Formula:	C11 H17 N3
SMILES:	Cc1nc(ccc1)N1CCCNCC1
InChi:	InChI=1S/C11H17N3/c1-10-4-2-5-11(13-10)14-8-3-6-12-7-9-14/h2,4-5,12H,3,6-9H2,1H3
Definition date:	2022-09-02
Last modified:	2022-10-28
Release date:	2022-11-02
Identifier:	1-(6-methylpyridin-2-yl)-1,4-diazepane

VBQ

VBQ
Name:	2-[(9-oxidanylidenefluoren-4-yl)carbonylamino]ethanoic acid
Formula:	C16 H11 N O4
SMILES:	OC(=O)CNC(=O)c1cccc2C(=O)c3ccccc3c12
InChi:	InChI=1S/C16H11NO4/c18-13(19)8-17-16(21)12-7-3-6-11-14(12)9-4-1-2-5-10(9)15(11)20/h1-7H,8H2,(H,17,21)(H,18,19)
Definition date:	2021-05-05
Last modified:	2022-10-28
Release date:	2022-11-02
Identifier:	2-[(9-oxidanylidenefluoren-4-yl)carbonylamino]ethanoic acid

VQU

VQU
Name:	(2R,4S)-2-(pyridin-3-yl)-1,3-thiazolidine-4-carboxylic acid
Formula:	C9 H10 N2 O2 S
SMILES:	OC(=O)C1NC(SC1)c1cnccc1
InChi:	InChI=1S/C9H10N2O2S/c12-9(13)7-5-14-8(11-7)6-2-1-3-10-4-6/h1-4,7-8,11H,5H2,(H,12,13)/t7-,8-/m1/s1
Definition date:	2022-09-02
Last modified:	2022-10-28
Release date:	2022-11-02
Identifier:	(2R,4S)-2-(pyridin-3-yl)-1,3-thiazolidine-4-carboxylic acid

VBX

VBX
Name:	N-methyl-2-{[2-(methylamino)-2-oxoethyl]amino}benzamide
Formula:	C11 H15 N3 O2
SMILES:	CNC(=O)c1ccccc1NCC(=O)NC
InChi:	InChI=1S/C11H15N3O2/c1-12-10(15)7-14-9-6-4-3-5-8(9)11(16)13-2/h3-6,14H,7H2,1-2H3,(H,12,15)(H,13,16)
Definition date:	2022-08-29
Last modified:	2022-10-28
Release date:	2022-11-02
Identifier:	N-methyl-2-{[2-(methylamino)-2-oxoethyl]amino}benzamide

W8B

W8B
Name:	4-chloro-5-(morpholin-4-yl)pyridazin-3(2H)-one
Formula:	C8 H10 Cl N3 O2
SMILES:	ClC1=C(C=NNC1=O)N1CCOCC1
InChi:	InChI=1S/C8H10ClN3O2/c9-7-6(5-10-11-8(7)13)12-1-3-14-4-2-12/h5H,1-4H2,(H,11,13)
Definition date:	2022-09-02
Last modified:	2022-10-28
Release date:	2022-11-02
Identifier:	4-chloro-5-(morpholin-4-yl)pyridazin-3(2H)-one

VR6

VR6
Name:	N-[(furan-2-yl)methyl]-2-[(pyridin-2-yl)oxy]ethan-1-amine
Formula:	C12 H14 N2 O2
SMILES:	C(CNCc1ccco1)Oc1ccccn1
InChi:	InChI=1S/C12H14N2O2/c1-2-6-14-12(5-1)16-9-7-13-10-11-4-3-8-15-11/h1-6,8,13H,7,9-10H2
Definition date:	2022-09-02
Last modified:	2022-10-28
Release date:	2022-11-02
Identifier:	N-[(furan-2-yl)methyl]-2-[(pyridin-2-yl)oxy]ethan-1-amine

VCB

VCB
Name:	(2~{R})-2-[(9-oxidanylidenefluoren-4-yl)carbonylamino]-2-phenyl-ethanoic acid
Formula:	C22 H15 N O4
SMILES:	OC(=O)[CH](NC(=O)c1cccc2C(=O)c3ccccc3c12)c4ccccc4
InChi:	InChI=1S/C22H15NO4/c24-20-15-10-5-4-9-14(15)18-16(20)11-6-12-17(18)21(25)23-19(22(26)27)13-7-2-1-3-8-13/h1-12,19H,(H,23,25)(H,26,27)/t19-/m1/s1
Definition date:	2021-05-05
Last modified:	2022-10-28
Release date:	2022-11-02
Identifier:	(2~{R})-2-[(9-oxidanylidenefluoren-4-yl)carbonylamino]-2-phenyl-ethanoic acid

VRH

VRH
Name:	N-methoxy-2-(2-methoxy-4-methylphenoxy)acetamide
Formula:	C11 H15 N O4
SMILES:	COc1cc(C)ccc1OCC(=O)NOC
InChi:	InChI=1S/C11H15NO4/c1-8-4-5-9(10(6-8)14-2)16-7-11(13)12-15-3/h4-6H,7H2,1-3H3,(H,12,13)
Definition date:	2022-09-02
Last modified:	2022-10-28
Release date:	2022-11-02
Identifier:	N-methoxy-2-(2-methoxy-4-methylphenoxy)acetamide

VRL

VRL
Name:	methyl (1R)-6-hydroxy-1,2,3,4-tetrahydroisoquinoline-1-carboxylate
Formula:	C11 H13 N O3
SMILES:	O=C(OC)C1NCCc2cc(O)ccc12
InChi:	InChI=1S/C11H13NO3/c1-15-11(14)10-9-3-2-8(13)6-7(9)4-5-12-10/h2-3,6,10,12-13H,4-5H2,1H3/t10-/m1/s1
Definition date:	2022-09-02
Last modified:	2022-10-28
Release date:	2022-11-02
Identifier:	methyl (1R)-6-hydroxy-1,2,3,4-tetrahydroisoquinoline-1-carboxylate

VCN

VCN
Name:	~{N},~{N}-diethyl-9-oxidanylidene-fluorene-4-carboxamide
Formula:	C18 H17 N O2
SMILES:	CCN(CC)C(=O)c1cccc2C(=O)c3ccccc3c12
InChi:	InChI=1S/C18H17NO2/c1-3-19(4-2)18(21)15-11-7-10-14-16(15)12-8-5-6-9-13(12)17(14)20/h5-11H,3-4H2,1-2H3
Definition date:	2021-05-05
Last modified:	2022-10-28
Release date:	2022-11-02
Identifier:	~{N},~{N}-diethyl-9-oxidanylidene-fluorene-4-carboxamide

VCO

VCO
Name:	ethyl (2Z)-(azepan-2-ylidene)(cyano)acetate
Formula:	C11 H16 N2 O2
SMILES:	O=C(OCC)C(C#N)=C1CCCCCN1
InChi:	InChI=1S/C11H16N2O2/c1-2-15-11(14)9(8-12)10-6-4-3-5-7-13-10/h13H,2-7H2,1H3/b10-9-
Definition date:	2022-08-29
Last modified:	2022-10-28
Release date:	2022-11-02
Identifier:	ethyl (2Z)-(azepan-2-ylidene)(cyano)acetate

VCQ

VCQ
Name:	(2~{S})-2-cyclopentyl-2-oxidanyl-2-phenyl-ethanoic acid
Formula:	C13 H16 O3
SMILES:	OC(=O)[C](O)(C1CCCC1)c2ccccc2
InChi:	InChI=1S/C13H16O3/c14-12(15)13(16,11-8-4-5-9-11)10-6-2-1-3-7-10/h1-3,6-7,11,16H,4-5,8-9H2,(H,14,15)/t13-/m1/s1
Definition date:	2021-05-05
Last modified:	2022-10-28
Release date:	2022-11-02
Identifier:	(2~{S})-2-cyclopentyl-2-oxidanyl-2-phenyl-ethanoic acid

VRR

VRR
Name:	ethyl N-benzyl-beta-alaninate
Formula:	C12 H17 N O2
SMILES:	O=C(OCC)CCNCc1ccccc1
InChi:	InChI=1S/C12H17NO2/c1-2-15-12(14)8-9-13-10-11-6-4-3-5-7-11/h3-7,13H,2,8-10H2,1H3
Definition date:	2022-09-02
Last modified:	2022-10-28
Release date:	2022-11-02
Identifier:	ethyl N-benzyl-beta-alaninate

VCT

VCT
Name:	~{N},~{N}-dimethyl-9-oxidanylidene-fluorene-4-carboxamide
Formula:	C16 H13 N O2
SMILES:	CN(C)C(=O)c1cccc2C(=O)c3ccccc3c12
InChi:	InChI=1S/C16H13NO2/c1-17(2)16(19)13-9-5-8-12-14(13)10-6-3-4-7-11(10)15(12)18/h3-9H,1-2H3
Definition date:	2021-05-05
Last modified:	2022-10-28
Release date:	2022-11-02
Identifier:	~{N},~{N}-dimethyl-9-oxidanylidene-fluorene-4-carboxamide

VRY

VRY
Name:	1-[(2-chloro-4-methoxyphenyl)methyl]-1H-1,2,4-triazole
Formula:	C10 H10 Cl N3 O
SMILES:	COc1cc(Cl)c(Cn2cncn2)cc1
InChi:	InChI=1S/C10H10ClN3O/c1-15-9-3-2-8(10(11)4-9)5-14-7-12-6-13-14/h2-4,6-7H,5H2,1H3
Definition date:	2022-09-02
Last modified:	2022-10-28
Release date:	2022-11-02
Identifier:	1-[(2-chloro-4-methoxyphenyl)methyl]-1H-1,2,4-triazole

W98

W98
Name:	N-cyclopropyl-N-[(thiophen-2-yl)methyl]methanesulfonamide
Formula:	C9 H13 N O2 S2
SMILES:	O=S(C)(=O)N(Cc1cccs1)C1CC1
InChi:	InChI=1S/C9H13NO2S2/c1-14(11,12)10(8-4-5-8)7-9-3-2-6-13-9/h2-3,6,8H,4-5,7H2,1H3
Definition date:	2022-09-02
Last modified:	2022-10-28
Release date:	2022-11-02
Identifier:	N-cyclopropyl-N-[(thiophen-2-yl)methyl]methanesulfonamide

VD6

VD6
Name:	(2R)-1-benzylpiperidine-2-carboxylic acid
Formula:	C13 H17 N O2
SMILES:	O=C(O)C1CCCCN1Cc1ccccc1
InChi:	InChI=1S/C13H17NO2/c15-13(16)12-8-4-5-9-14(12)10-11-6-2-1-3-7-11/h1-3,6-7,12H,4-5,8-10H2,(H,15,16)/t12-/m1/s1
Definition date:	2022-08-29
Last modified:	2022-10-28
Release date:	2022-11-02
Identifier:	(2R)-1-benzylpiperidine-2-carboxylic acid

W9E

W9E
Name:	N-hydroxy-4-(trifluoromethyl)benzene-1-carboximidamide
Formula:	C8 H7 F3 N2 O
SMILES:	FC(F)(F)c1ccc(cc1)C(=N)NO
InChi:	InChI=1S/C8H7F3N2O/c9-8(10,11)6-3-1-5(2-4-6)7(12)13-14/h1-4,14H,(H2,12,13)
Definition date:	2022-09-02
Last modified:	2022-10-28
Release date:	2022-11-02
Identifier:	N-hydroxy-4-(trifluoromethyl)benzene-1-carboximidamide

W9O

W9O
Name:	N-methyl-1-{(1S,2R)-2-[(1,2,4-triazolidin-1-yl)methyl]cyclohexyl}methanamine
Formula:	C11 H24 N4
SMILES:	CNCC1CCCCC1CN1CNCN1
InChi:	InChI=1S/C11H24N4/c1-12-6-10-4-2-3-5-11(10)7-15-9-13-8-14-15/h10-14H,2-9H2,1H3/t10-,11+/m1/s1
Definition date:	2022-09-02
Last modified:	2022-10-28
Release date:	2022-11-02
Identifier:	N-methyl-1-{(1S,2R)-2-[(1,2,4-triazolidin-1-yl)methyl]cyclohexyl}methanamine

VDI

VDI
Name:	1-(4-chlorophenyl)cyclobutane-1-carboxylic acid
Formula:	C11 H11 Cl O2
SMILES:	OC(=O)C1(CCC1)c1ccc(Cl)cc1
InChi:	InChI=1S/C11H11ClO2/c12-9-4-2-8(3-5-9)11(10(13)14)6-1-7-11/h2-5H,1,6-7H2,(H,13,14)
Definition date:	2022-08-29
Last modified:	2022-10-28
Release date:	2022-11-02
Identifier:	1-(4-chlorophenyl)cyclobutane-1-carboxylic acid

W9U

W9U
Name:	cyclohexyl[4-(hydroxyamino)piperidin-1-yl]methanone
Formula:	C12 H22 N2 O2
SMILES:	O=C(C1CCCCC1)N1CCC(NO)CC1
InChi:	InChI=1S/C12H22N2O2/c15-12(10-4-2-1-3-5-10)14-8-6-11(13-16)7-9-14/h10-11,13,16H,1-9H2
Definition date:	2022-09-02
Last modified:	2022-10-28
Release date:	2022-11-02
Identifier:	cyclohexyl[4-(hydroxyamino)piperidin-1-yl]methanone

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