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NFA

NFA
Name:	PHENYLALANINE AMIDE
Formula:	C9 H12 N2 O
SMILES:	O=C(N)C(N)Cc1ccccc1
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-/m0/s1
Definition date:	1999-07-08
Last modified:	2025-07-07
Identifier:	L-phenylalaninamide

A1B8D

A1B8D
Name:	N-(2,1,3-benzoxadiazol-4-yl)-3-(4-methoxybenzene-1-sulfonamido)benzamide
Formula:	C20 H16 N4 O5 S
SMILES:	COc1ccc(cc1)S(=O)(=O)Nc1cccc(c1)C(=O)Nc1cccc2nonc12
InChi:	InChI=1S/C20H16N4O5S/c1-28-15-8-10-16(11-9-15)30(26,27)24-14-5-2-4-13(12-14)20(25)21-17-6-3-7-18-19(17)23-29-22-18/h2-12,24H,1H3,(H,21,25)
Definition date:	2025-04-10
Last modified:	2025-07-04
Release date:	2025-07-09
Identifier:	N-(2,1,3-benzoxadiazol-4-yl)-3-(4-methoxybenzene-1-sulfonamido)benzamide

MI7

MI7
Name:	7-METHOXY-1H-INDAZOLE
Formula:	C8 H8 N2 O
SMILES:	n2cc1cccc(OC)c1n2
InChi:	InChI=1S/C8H8N2O/c1-11-7-4-2-3-6-5-9-10-8(6)7/h2-5H,1H3,(H,9,10)
Definition date:	2005-10-17
Last modified:	2025-07-04
Release date:	2025-07-09
Identifier:	7-methoxy-1H-indazole

A1CBI

A1CBI
Name:	1-[5-[oxidanyl(oxidanylidene)-$l^{4}-azanyl]-2,3-dihydroindol-1-yl]ethanone
Formula:	C10 H10 N2 O3
SMILES:	[O-][N+](=O)c1cc2CCN(c2cc1)C(C)=O
InChi:	InChI=1S/C10H10N2O3/c1-7(13)11-5-4-8-6-9(12(14)15)2-3-10(8)11/h2-3,6H,4-5H2,1H3
Definition date:	2025-05-07
Last modified:	2025-07-04
Release date:	2025-07-09
Identifier:	1-(5-nitro-2,3-dihydro-1H-indol-1-yl)ethan-1-one

A1CBJ

A1CBJ
Name:	1-(propan-2-yl)-4-[(pyridin-2-yl)methyl]piperazine
Formula:	C13 H21 N3
SMILES:	CC(C)N1CCN(Cc2ccccn2)CC1
InChi:	InChI=1S/C13H21N3/c1-12(2)16-9-7-15(8-10-16)11-13-5-3-4-6-14-13/h3-6,12H,7-11H2,1-2H3
Definition date:	2025-05-07
Last modified:	2025-07-04
Release date:	2025-07-09
Identifier:	1-(propan-2-yl)-4-[(pyridin-2-yl)methyl]piperazine

A1CBL

A1CBL
Name:	1-[(2-fluorophenyl)methyl]-4-(propan-2-yl)piperazine
Formula:	C14 H21 F N2
SMILES:	CC(C)N1CCN(Cc2ccccc2F)CC1
InChi:	InChI=1S/C14H21FN2/c1-12(2)17-9-7-16(8-10-17)11-13-5-3-4-6-14(13)15/h3-6,12H,7-11H2,1-2H3
Definition date:	2025-05-07
Last modified:	2025-07-04
Release date:	2025-07-09
Identifier:	1-[(2-fluorophenyl)methyl]-4-(propan-2-yl)piperazine

A1CBM

A1CBM
Name:	2-(5-amino-1H-1,3-benzimidazol-1-yl)ethan-1-ol
Formula:	C9 H11 N3 O
SMILES:	Nc1cc2ncn(CCO)c2cc1
InChi:	InChI=1S/C9H11N3O/c10-7-1-2-9-8(5-7)11-6-12(9)3-4-13/h1-2,5-6,13H,3-4,10H2
Definition date:	2025-05-07
Last modified:	2025-07-04
Release date:	2025-07-09
Identifier:	2-(5-amino-1H-1,3-benzimidazol-1-yl)ethan-1-ol

A1EL9

A1EL9
Name:	(2~{S})-2-[[(2~{R},4~{a}~{S},6~{a}~{R},6~{a}~{S},14~{a}~{S},14~{b}~{R})-2,4~{a},6~{a},6~{a},9,14~{a}-hexamethyl-10-oxidanyl-11-oxidanylidene-1,3,4,5,6,13,14,14~{b}-octahydropicen-2-yl]carbamoylamino]butanoic acid
Formula:	C33 H46 N2 O5
SMILES:	CC[CH](NC(=O)N[C]1(C)CC[C]2(C)CC[C]3(C)C4=CC=C5C(=C(O)C(=O)C=C5[C]4(C)CC[C]3(C)[CH]2C1)C)C(O)=O
InChi:	InChI=1S/C33H46N2O5/c1-8-22(27(38)39)34-28(40)35-30(4)13-11-29(3)12-15-32(6)24-10-9-20-19(2)26(37)23(36)17-21(20)31(24,5)14-16-33(32,7)25(29)18-30/h9-10,17,22,25,37H,8,11-16,18H2,1-7H3,(H,38,39)(H2,34,35,40)/t22?,25?,29-,30-,31+,32-,33+/m1/s1
Definition date:	2025-02-18
Last modified:	2025-07-04
Release date:	2025-07-09
Identifier:	(2~{S})-2-[[(2~{R},4~{a}~{S},6~{a}~{R},6~{a}~{S},14~{a}~{S},14~{b}~{R})-2,4~{a},6~{a},6~{a},9,14~{a}-hexamethyl-10-oxidanyl-11-oxidanylidene-1,3,4,5,6,13,14,14~{b}-octahydropicen-2-yl]carbamoylamino]butanoic acid

A1EOR

A1EOR
Name:	(2~{R},4~{S})-2-[(1~{R})-1-[[(2~{R})-2-azanyl-2-(4-hydroxyphenyl)ethanoyl]amino]-2-oxidanyl-2-oxidanylidene-ethyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid
Formula:	C16 H21 N3 O6 S
SMILES:	CC1(C)S[CH](N[CH]1C(O)=O)[CH](NC(=O)[CH](N)c2ccc(O)cc2)C(O)=O
InChi:	InChI=1S/C16H21N3O6S/c1-16(2)11(15(24)25)19-13(26-16)10(14(22)23)18-12(21)9(17)7-3-5-8(20)6-4-7/h3-6,9-11,13,19-20H,17H2,1-2H3,(H,18,21)(H,22,23)(H,24,25)/t9-,10+,11+,13-/m1/s1
Synonyms:	Amoxicilloic acid
Definition date:	2025-04-04
Last modified:	2025-07-04
Release date:	2025-07-09
Identifier:	(2~{R},4~{S})-2-[(1~{R})-1-[[(2~{R})-2-azanyl-2-(4-hydroxyphenyl)ethanoyl]amino]-2-oxidanyl-2-oxidanylidene-ethyl]-5,5-dimethyl-1,3-thiazolidine-4-carboxylic acid

A1I56

A1I56
Name:	5-[[(3-methoxyphenyl)amino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Formula:	C12 H11 N3 O3 S
SMILES:	COc1cccc(NC=C2C(=O)NC(=S)NC2=O)c1
InChi:	InChI=1S/C12H11N3O3S/c1-18-8-4-2-3-7(5-8)13-6-9-10(16)14-12(19)15-11(9)17/h2-6,13H,1H3,(H2,14,15,16,17,19)
Definition date:	2025-03-13
Last modified:	2025-07-04
Release date:	2025-07-09
Identifier:	5-[[(3-methoxyphenyl)amino]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

A1I5U

A1I5U
Name:	6-sulfanylidene-1,7-dihydropyrazolo[3,4-d]pyrimidin-4-one
Formula:	C5 H4 N4 O S
SMILES:	O=C1NC(=S)Nc2[nH]ncc12
InChi:	InChI=1S/C5H4N4OS/c10-4-2-1-6-9-3(2)7-5(11)8-4/h1H,(H3,6,7,8,9,10,11)
Definition date:	2025-03-11
Last modified:	2025-07-04
Release date:	2025-07-09
Identifier:	6-sulfanylidene-1,7-dihydropyrazolo[3,4-d]pyrimidin-4-one

A1IGE

A1IGE
Name:	(3~{a}~{S})-1-(2-methoxypyridin-4-yl)-6,7-dimethyl-3~{a}-oxidanyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-one
Formula:	C19 H19 N3 O3
SMILES:	COc1cc(ccn1)N2CC[C]3(O)C(=O)c4cc(C)c(C)cc4N=C23
InChi:	InChI=1S/C19H19N3O3/c1-11-8-14-15(9-12(11)2)21-18-19(24,17(14)23)5-7-22(18)13-4-6-20-16(10-13)25-3/h4,6,8-10,24H,5,7H2,1-3H3/t19-/m1/s1
Definition date:	2024-06-27
Last modified:	2025-07-04
Release date:	2025-07-09
Identifier:	(3~{a}~{S})-1-(2-methoxypyridin-4-yl)-6,7-dimethyl-3~{a}-oxidanyl-2,3-dihydropyrrolo[2,3-b]quinolin-4-one

A1IGF

A1IGF
Name:	1-(3-bromanyl-4-methyl-phenyl)-2-(4-methylphenyl)imidazole
Formula:	C17 H15 Br N2
SMILES:	Cc1ccc(cc1)c2nccn2c3ccc(C)c(Br)c3
InChi:	InChI=1S/C17H15BrN2/c1-12-3-6-14(7-4-12)17-19-9-10-20(17)15-8-5-13(2)16(18)11-15/h3-11H,1-2H3
Definition date:	2024-06-28
Last modified:	2025-07-04
Release date:	2025-07-09
Identifier:	1-(3-bromanyl-4-methyl-phenyl)-2-(4-methylphenyl)imidazole

A1IGQ

A1IGQ
Name:	(4R)-4-phenyl-1,2-thiazolidine 1,1-dioxide
Formula:	C9 H11 N O2 S
SMILES:	O=[S]1(=O)C[CH](CN1)c2ccccc2
InChi:	InChI=1S/C9H11NO2S/c11-13(12)7-9(6-10-13)8-4-2-1-3-5-8/h1-5,9-10H,6-7H2/t9-/m0/s1
Definition date:	2024-07-01
Last modified:	2025-07-04
Release date:	2025-07-09
Identifier:	(4~{R})-4-phenyl-1,2-thiazolidine 1,1-dioxide

A1IGR

A1IGR
Name:	1H-indole-3-carboxamide
Formula:	C9 H8 N2 O
SMILES:	NC(=O)c1c[nH]c2ccccc12
InChi:	InChI=1S/C9H8N2O/c10-9(12)7-5-11-8-4-2-1-3-6(7)8/h1-5,11H,(H2,10,12)
Definition date:	2024-07-01
Last modified:	2025-07-04
Release date:	2025-07-09
Identifier:	1~{H}-indole-3-carboxamide

A1IGY

A1IGY
Name:	(Z)-7-(4-chlorobenzyl)-1-(3-hydroxypropyl)-3-methyl-8-(4-(phenyldiazenyl)-3-(trifluoromethoxy)phenoxy)-3,7-dihydro-1H-purine-2,6-dione
Formula:	C29 H24 Cl F3 N6 O5
SMILES:	CN1C(=O)N(CCCO)C(=O)c2n(Cc3ccc(Cl)cc3)c(Oc4ccc(N=Nc5ccccc5)c(OC(F)(F)F)c4)nc12
InChi:	InChI=1S/C29H24ClF3N6O5/c1-37-25-24(26(41)38(28(37)42)14-5-15-40)39(17-18-8-10-19(30)11-9-18)27(34-25)43-21-12-13-22(23(16-21)44-29(31,32)33)36-35-20-6-3-2-4-7-20/h2-4,6-13,16,40H,5,14-15,17H2,1H3/b36-35-
Synonyms:	7-[(4-chlorophenyl)methyl]-3-methyl-1-(3-oxidanylpropyl)-8-[4-[(~{Z})-phenyldiazenyl]-3-(trifluoromethyloxy)phenoxy]purine-2,6-dione
Definition date:	2024-07-02
Last modified:	2025-07-04
Release date:	2025-07-09
Identifier:	7-[(4-chlorophenyl)methyl]-3-methyl-1-(3-oxidanylpropyl)-8-[4-[(~{Z})-phenyldiazenyl]-3-(trifluoromethyloxy)phenoxy]purine-2,6-dione

A1JCJ

A1JCJ
Name:	~{N}-(3-chlorophenyl)-2-sulfanyl-ethanamide
Formula:	C8 H8 Cl N O S
SMILES:	SCC(=O)Nc1cccc(Cl)c1
InChi:	InChI=1S/C8H8ClNOS/c9-6-2-1-3-7(4-6)10-8(11)5-12/h1-4,12H,5H2,(H,10,11)
Definition date:	2025-05-07
Last modified:	2025-07-04
Release date:	2025-07-09
Identifier:	~{N}-(3-chlorophenyl)-2-sulfanyl-ethanamide

A1JCK

A1JCK
Name:	~{N}-naphthalen-2-yl-2-sulfanyl-ethanamide
Formula:	C12 H11 N O S
SMILES:	SCC(=O)Nc1ccc2ccccc2c1
InChi:	InChI=1S/C12H11NOS/c14-12(8-15)13-11-6-5-9-3-1-2-4-10(9)7-11/h1-7,15H,8H2,(H,13,14)
Synonyms:	SGMHGVVTMOGJMX-UHFFFAOYSA-N
Definition date:	2025-05-07
Last modified:	2025-07-04
Release date:	2025-07-09
Identifier:	~{N}-naphthalen-2-yl-2-sulfanyl-ethanamide

A1JF8

A1JF8
Name:	~{N}-(5-cyclopentyl-1~{H}-pyrazol-3-yl)-4-fluoranyl-2-nitro-benzamide
Formula:	C15 H15 F N4 O3
SMILES:	[O-][N+](=O)c1cc(F)ccc1C(=O)Nc2cc([nH]n2)C3CCCC3
InChi:	InChI=1S/C15H15FN4O3/c16-10-5-6-11(13(7-10)20(22)23)15(21)17-14-8-12(18-19-14)9-3-1-2-4-9/h5-9H,1-4H2,(H2,17,18,19,21)
Definition date:	2025-06-10
Last modified:	2025-07-04
Release date:	2025-07-09
Identifier:	~{N}-(5-cyclopentyl-1~{H}-pyrazol-3-yl)-4-fluoranyl-2-nitro-benzamide

A1JGB

A1JGB
Name:	~{N}-(2,3-dihydro-1~{H}-inden-2-yl)-2-pyridin-3-yl-~{N}-(thiophen-2-ylmethyl)ethanamide
Formula:	C21 H20 N2 O S
SMILES:	O=C(Cc1cccnc1)N(Cc2sccc2)C3Cc4ccccc4C3
InChi:	InChI=1S/C21H20N2OS/c24-21(11-16-5-3-9-22-14-16)23(15-20-8-4-10-25-20)19-12-17-6-1-2-7-18(17)13-19/h1-10,14,19H,11-13,15H2
Definition date:	2025-06-11
Last modified:	2025-07-04
Release date:	2025-07-09
Identifier:	~{N}-(2,3-dihydro-1~{H}-inden-2-yl)-2-pyridin-3-yl-~{N}-(thiophen-2-ylmethyl)ethanamide

A1JGE

A1JGE
Name:	2-pyridin-3-ylquinazoline
Formula:	C13 H9 N3
SMILES:	c1ccc2nc(ncc2c1)c3cccnc3
InChi:	InChI=1S/C13H9N3/c1-2-6-12-10(4-1)9-15-13(16-12)11-5-3-7-14-8-11/h1-9H
Definition date:	2025-06-11
Last modified:	2025-07-04
Release date:	2025-07-09
Identifier:	2-pyridin-3-ylquinazoline

A1JGF

A1JGF
Name:	[1-[[5-chloranyl-1-(phenylmethyl)benzimidazol-2-yl]methyl]-1,2,4-triazol-3-yl]methanamine
Formula:	C18 H17 Cl N6
SMILES:	NCc1ncn(Cc2nc3cc(Cl)ccc3n2Cc4ccccc4)n1
InChi:	InChI=1S/C18H17ClN6/c19-14-6-7-16-15(8-14)22-18(11-24-12-21-17(9-20)23-24)25(16)10-13-4-2-1-3-5-13/h1-8,12H,9-11,20H2
Definition date:	2025-06-11
Last modified:	2025-07-04
Release date:	2025-07-09
Identifier:	[1-[[5-chloranyl-1-(phenylmethyl)benzimidazol-2-yl]methyl]-1,2,4-triazol-3-yl]methanamine

A1JGO

A1JGO
Name:	1-(benzimidazol-1-yl)-3-[(4~{S})-6-fluoranyl-3,4-dihydro-2~{H}-thiochromen-4-yl]urea
Formula:	C17 H15 F N4 O S
SMILES:	Fc1ccc2SCC[CH](NC(=O)Nn3cnc4ccccc34)c2c1
InChi:	InChI=1S/C17H15FN4OS/c18-11-5-6-16-12(9-11)13(7-8-24-16)20-17(23)21-22-10-19-14-3-1-2-4-15(14)22/h1-6,9-10,13H,7-8H2,(H2,20,21,23)/t13-/m0/s1
Definition date:	2025-06-12
Last modified:	2025-07-04
Release date:	2025-07-09
Identifier:	1-(benzimidazol-1-yl)-3-[(4~{S})-6-fluoranyl-3,4-dihydro-2~{H}-thiochromen-4-yl]urea

A1JGR

A1JGR
Name:	1-(2-cyclohexylethyl)-3-cyclopropyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]urea
Formula:	C17 H27 N3 O2
SMILES:	Cc1onc(CN(CCC2CCCCC2)C(=O)NC3CC3)c1
InChi:	InChI=1S/C17H27N3O2/c1-13-11-16(19-22-13)12-20(17(21)18-15-7-8-15)10-9-14-5-3-2-4-6-14/h11,14-15H,2-10,12H2,1H3,(H,18,21)
Definition date:	2025-06-12
Last modified:	2025-07-04
Release date:	2025-07-09
Identifier:	1-(2-cyclohexylethyl)-3-cyclopropyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]urea

A1JGU

A1JGU
Name:	3-(5-bromanylpyridin-3-yl)-1-[(1~{R})-1-phenylethyl]imidazolidine-2,4-dione
Formula:	C16 H14 Br N3 O2
SMILES:	C[CH](N1CC(=O)N(C1=O)c2cncc(Br)c2)c3ccccc3
InChi:	InChI=1S/C16H14BrN3O2/c1-11(12-5-3-2-4-6-12)19-10-15(21)20(16(19)22)14-7-13(17)8-18-9-14/h2-9,11H,10H2,1H3/t11-/m1/s1
Definition date:	2025-06-12
Last modified:	2025-07-04
Release date:	2025-07-09
Identifier:	3-(5-bromanylpyridin-3-yl)-1-[(1~{R})-1-phenylethyl]imidazolidine-2,4-dione

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