CAS RN: 6839-90-3
CAS Name: [(E)-1-(2-pyridinyl)ethylideneamino]thiourea
OPENEYE Name: [(E)-1-(2-pyridyl)ethylideneamino]thiourea
IUPAC Name: [(E)-1-pyridin-2-ylethylideneamino]thiourea
SYSTEMATIC NAME: 1-[(E)-1-pyridin-2-ylethylideneamino]thiourea
MOLECULAR FORMULA: C8H10N4S
MOLECULAR WEIGHT: 194.2568
SMILES: C/C(=N\NC(=S)N)/C1=CC=CC=N1
Structure:
CAS RN: 142564-62-3
CAS Name: [(E)-1-(2-pyridinyl)ethylideneamino]thiourea
OPENEYE Name: [(E)-1-(2-pyridyl)ethylideneamino]thiourea
IUPAC Name: [(E)-1-pyridin-2-ylethylideneamino]thiourea
SYSTEMATIC NAME: 1-[(E)-1-pyridin-2-ylethylideneamino]thiourea
MOLECULAR FORMULA: C8H10N4S
MOLECULAR WEIGHT: 194.2568
SMILES: C/C(=N\NC(=S)N)/C1=CC=CC=N1
Structure:
CAS RN: 201341-11-9
CAS Name: N,N-dipropylcarbamic acid [[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-[[(dipropylamino)-oxomethoxy]methoxy]phosphoryl]oxymethyl ester
OPENEYE Name: [[(1R)-2-(6-aminopurin-9-yl)-1-methyl-ethoxy]methyl-(dipropylcarbamoyloxymethoxy)phosphoryl]oxymethyl N,N-dipropylcarbamate
IUPAC Name: [[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-(dipropylcarbamoyloxymethoxy)phosphoryl]oxymethyl N,N-dipropylcarbamate
SYSTEMATIC NAME: [[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-(dipropylcarbamoyloxymethoxy)phosphoryl]oxymethyl N,N-dipropylcarbamate
MOLECULAR FORMULA: C25H44N7O8P
MOLECULAR WEIGHT: 601.632721
SMILES: CCCN(CCC)C(=O)OCOP(=O)(CO[C@H](C)CN1C=NC2=C1N=CN=C2N)OCOC(=O)N(CCC)CCC
Structure:
CAS RN: 3622-72-8
CAS Name: [(E)-decan-2-ylideneamino]urea
OPENEYE Name: [(E)-1-methylnonylideneamino]urea
IUPAC Name: [(E)-decan-2-ylideneamino]urea
SYSTEMATIC NAME: 1-[(E)-decan-2-ylideneamino]urea
MOLECULAR FORMULA: C11H23N3O
MOLECULAR WEIGHT: 213.31982
SMILES: CCCCCCCC/C(=N/NC(=O)N)/C
Structure:
CAS RN: 600-20-4
CAS Name: 3-methyl-2-butanone oxime
OPENEYE Name: 3-methylbutan-2-one oxime
IUPAC Name: (NE)-N-(3-methylbutan-2-ylidene)hydroxylamine
SYSTEMATIC NAME: (NE)-N-(3-methylbutan-2-ylidene)hydroxylamine
MOLECULAR FORMULA: C5H11NO
MOLECULAR WEIGHT: 101.14694
SMILES: CC(C)/C(=N/O)/C
Structure:
CAS RN: 157726-04-0
CAS Name: (2R,3S)-N-[(2S)-6-acetamido-1-(methylamino)-1-oxohexan-2-yl]-N'-hydroxy-3-[[(4-hydroxyphenyl)thio]methyl]-2-(2-methylpropyl)butanediamide
OPENEYE Name: (2R)-N-[(1S)-5-acetamido-1-(methylcarbamoyl)pentyl]-2-[(1S)-2-(hydroxyamino)-1-[(4-hydroxyphenyl)sulfanylmethyl]-2-oxo-ethyl]-4-methyl-pentanamide
IUPAC Name: (2R,3S)-N-[(2S)-6-acetamido-1-(methylamino)-1-oxohexan-2-yl]-N'-hydroxy-3-[(4-hydroxyphenyl)sulfanylmethyl]-2-(2-methylpropyl)butanediamide
SYSTEMATIC NAME: (2R,3S)-N-[(2S)-6-acetamido-1-(methylamino)-1-oxidanylidene-hexan-2-yl]-3-[(4-hydroxyphenyl)sulfanylmethyl]-2-(2-methylpropyl)-N'-oxidanyl-butanediamide
MOLECULAR FORMULA: C24H38N4O6S
MOLECULAR WEIGHT: 510.64672
SMILES: CC(C)C[C@H]([C@H](CSC1=CC=C(C=C1)O)C(=O)NO)C(=O)N[C@@H](CCCCNC(=O)C)C(=O)NC
Structure:
CAS RN: 201340-95-6
CAS Name: carbonic acid [[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-(ethoxycarbonyloxymethoxy)phosphoryl]oxymethyl ethyl ester
OPENEYE Name: [[(1R)-2-(6-aminopurin-9-yl)-1-methyl-ethoxy]methyl-(ethoxycarbonyloxymethoxy)phosphoryl]oxymethyl ethyl carbonate
IUPAC Name: [[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-(ethoxycarbonyloxymethoxy)phosphoryl]oxymethyl ethyl carbonate
SYSTEMATIC NAME: [[(2R)-1-(6-aminopurin-9-yl)propan-2-yl]oxymethyl-(ethoxycarbonyloxymethoxy)phosphoryl]oxymethyl ethyl carbonate
MOLECULAR FORMULA: C17H26N5O10P
MOLECULAR WEIGHT: 491.389601
SMILES: CCOC(=O)OCOP(=O)(CO[C@H](C)CN1C=NC2=C1N=CN=C2N)OCOC(=O)OCC
Structure:
CAS RN: 13785-20-1
CAS Name: (7E)-7-[(2E)-2-(1,6-dimethyl-2-quinolinylidene)ethylidene]-5-methyl-8-quinolin-1-iumone
OPENEYE Name: (7E)-7-[(2E)-2-(1,6-dimethyl-2-quinolylidene)ethylidene]-5-methyl-quinolin-1-ium-8-one
IUPAC Name: (7E)-7-[(2E)-2-(1,6-dimethylquinolin-2-ylidene)ethylidene]-5-methylquinolin-1-ium-8-one
SYSTEMATIC NAME: (7E)-7-[(2E)-2-(1,6-dimethylquinolin-2-ylidene)ethylidene]-5-methyl-quinolin-1-ium-8-one
MOLECULAR FORMULA: C23H21N2O+
MOLECULAR WEIGHT: 341.42564
SMILES: CC1=CC2=C(C=C1)N(/C(=C/C=C/3\C=C(C4=C(C3=O)[NH+]=CC=C4)C)/C=C2)C
Structure:
CAS RN: 70038-77-6
CAS Name: 2,3,9-trimethyl-6H-indolo[3,2-b]quinoxaline
OPENEYE Name: 2,3,9-trimethyl-6H-indolo[3,2-b]quinoxaline
IUPAC Name: 2,3,9-trimethyl-6H-indolo[3,2-b]quinoxaline
SYSTEMATIC NAME: 2,3,9-trimethyl-6H-indolo[3,2-b]quinoxaline
MOLECULAR FORMULA: C17H15N3
MOLECULAR WEIGHT: 261.3211
SMILES: CC1=CC2=C(C=C1)NC3=NC4=C(C=C(C(=C4)C)C)N=C23
Structure:
CAS RN: 84989-99-1
CAS Name: (4Z)-7,9-dichloro-8-hydroxy-4-[(4-methoxyanilino)methylidene]-3-dibenzofuranone
OPENEYE Name: (4Z)-7,9-dichloro-8-hydroxy-4-[(4-methoxyanilino)methylene]dibenzofuran-3-one
IUPAC Name: (4Z)-7,9-dichloro-8-hydroxy-4-[(4-methoxyanilino)methylidene]dibenzofuran-3-one
SYSTEMATIC NAME: (4Z)-7,9-bis(chloranyl)-4-[[(4-methoxyphenyl)amino]methylidene]-8-oxidanyl-dibenzofuran-3-one
MOLECULAR FORMULA: C20H13Cl2NO4
MOLECULAR WEIGHT: 402.22752
SMILES: COC1=CC=C(C=C1)N/C=C/2\C(=O)C=CC3=C2OC4=CC(=C(C(=C34)Cl)O)Cl
Structure:
CAS RN: 78649-93-1
CAS Name: (5Z)-3-amino-5-(nitromethylidene)-4-dithiolecarboxylic acid methyl ester
OPENEYE Name: methyl (5Z)-3-amino-5-(nitromethylene)dithiole-4-carboxylate
IUPAC Name: methyl (5Z)-3-amino-5-(nitromethylidene)dithiole-4-carboxylate
SYSTEMATIC NAME: methyl (5Z)-3-azanyl-5-(nitromethylidene)-1,2-dithiole-4-carboxylate
MOLECULAR FORMULA: C6H6N2O4S2
MOLECULAR WEIGHT: 234.25284
SMILES: COC(=O)C\1=C(SS/C1=C\[N+](=O)[O-])N
Structure:
CAS RN: 108605-62-5
CAS Name: (2Z)-2-[hydroxy-[4-(trifluoromethyl)anilino]methylidene]-3-oxobutanenitrile
OPENEYE Name: (2Z)-2-[hydroxy-[4-(trifluoromethyl)anilino]methylene]-3-oxo-butanenitrile
IUPAC Name: (2Z)-2-[hydroxy-[4-(trifluoromethyl)anilino]methylidene]-3-oxobutanenitrile
SYSTEMATIC NAME: (2Z)-3-oxidanylidene-2-[oxidanyl-[[4-(trifluoromethyl)phenyl]amino]methylidene]butanenitrile
MOLECULAR FORMULA: C12H9F3N2O2
MOLECULAR WEIGHT: 270.20727
SMILES: CC(=O)/C(=C(/NC1=CC=C(C=C1)C(F)(F)F)\O)/C#N
Structure:
CAS RN: 77712-45-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C22H10Cl2N8O2S2
MOLECULAR WEIGHT: 553.4032
SMILES: C1=C/C(=C\2/NN=C3N2N=C4C(=C(C5=NN6/C(=C\7/C=CC=CC7=O)/NN=C6SC5=C4Cl)Cl)S3)/C(=O)C=C1
Structure:
CAS RN: 595-05-1
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C22H26N4
MOLECULAR WEIGHT: 346.46864
SMILES: CN1CC[C@@]23[C@H]4NC5=CC=CC=C5[C@@]2([C@H]1NC6=CC=CC=C36)CCN4C
Structure:
CAS RN: 2508-89-6
CAS Name: (Z)-5-acetamido-1-diazonio-6-hydroxy-6-oxo-1-hexen-2-olate
OPENEYE Name: (Z)-5-acetamido-1-diazonio-6-hydroxy-6-oxo-hex-1-en-2-olate
IUPAC Name: (Z)-5-acetamido-1-diazonio-6-hydroxy-6-oxohex-1-en-2-olate
SYSTEMATIC NAME: (Z)-5-acetamido-1-diazonio-6-oxidanyl-6-oxidanylidene-hex-1-en-2-olate
MOLECULAR FORMULA: C8H11N3O4
MOLECULAR WEIGHT: 213.19064
SMILES: CC(=O)NC(CC/C(=C/[N+]#N)/[O-])C(=O)O
Structure:
CAS RN: 146555-81-9
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C18H17N3O2
MOLECULAR WEIGHT: 307.34648
SMILES: C1CNC2=C3C1=CN=C3C(=O)C(=C2)NCCC4=CC=C(C=C4)O
Structure:
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