CAS RN: 83717-71-9
CAS Name: 4-nitro-N-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)benzamide
OPENEYE Name: 4-nitro-N-(4-oxo-2-thioxo-1H-quinazolin-3-yl)benzamide
IUPAC Name: 4-nitro-N-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)benzamide
SYSTEMATIC NAME: 4-nitro-N-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)benzamide
MOLECULAR FORMULA: C15H10N4O4S
MOLECULAR WEIGHT: 342.3293
SMILES: C1=CC=C2C(=C1)C(=O)N(C(=S)N2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]
Structure:
CAS RN: 6824-08-4
CAS Name: [(2-oxo-3H-quinazolin-4-yl)methylideneamino]thiourea
OPENEYE Name: [(2-oxo-3H-quinazolin-4-yl)methyleneamino]thiourea
IUPAC Name: [(2-oxo-3H-quinazolin-4-yl)methylideneamino]thiourea
SYSTEMATIC NAME: 1-[(2-oxidanylidene-3H-quinazolin-4-yl)methylideneamino]thiourea
MOLECULAR FORMULA: C10H9N5OS
MOLECULAR WEIGHT: 247.27636
SMILES: C1=CC2=C(NC(=O)N=C2C=C1)C=NNC(=S)N
Structure:
CAS RN: 66359-13-5
CAS Name: 5-hexyl-3-phenyl-2-sulfanylidene-4-imidazolidinone
OPENEYE Name: 5-hexyl-3-phenyl-2-thioxo-imidazolidin-4-one
IUPAC Name: 5-hexyl-3-phenyl-2-sulfanylideneimidazolidin-4-one
SYSTEMATIC NAME: 5-hexyl-3-phenyl-2-sulfanylidene-imidazolidin-4-one
MOLECULAR FORMULA: C15H20N2OS
MOLECULAR WEIGHT: 276.3971
SMILES: CCCCCCC1C(=O)N(C(=S)N1)C2=CC=CC=C2
Structure:
CAS RN: 79815-19-3
CAS Name: 1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid methyl ester
OPENEYE Name: methyl 1,2,3,4-tetrahydroisoquinoline-3-carboxylate
IUPAC Name: methyl 1,2,3,4-tetrahydroisoquinoline-3-carboxylate
SYSTEMATIC NAME: methyl 1,2,3,4-tetrahydroisoquinoline-3-carboxylate
MOLECULAR FORMULA: C11H13NO2
MOLECULAR WEIGHT: 191.22642
SMILES: COC(=O)C1CC2=CC=CC=C2CN1
Structure:
CAS RN: 1596-65-2
CAS Name: 2-amino-3-(2-thiazolyl)propanoic acid
OPENEYE Name: 2-amino-3-thiazol-2-yl-propanoic acid
IUPAC Name: 2-amino-3-(1,3-thiazol-2-yl)propanoic acid
SYSTEMATIC NAME: 2-azanyl-3-(1,3-thiazol-2-yl)propanoic acid
MOLECULAR FORMULA: C6H8N2O2S
MOLECULAR WEIGHT: 172.20492
SMILES: C1=CSC(=N1)CC(C(=O)O)N
Structure:
CAS RN: 56742-05-3
CAS Name: N-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)-2-nitrobenzamide
OPENEYE Name: N-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)-2-nitro-benzamide
IUPAC Name: N-(6-methyl-2,4-dioxo-1H-pyrimidin-5-yl)-2-nitrobenzamide
SYSTEMATIC NAME: N-[6-methyl-2,4-bis(oxidanylidene)-1H-pyrimidin-5-yl]-2-nitro-benzamide
MOLECULAR FORMULA: C12H10N4O5
MOLECULAR WEIGHT: 290.2316
SMILES: CC1=C(C(=O)NC(=O)N1)NC(=O)C2=CC=CC=C2[N+](=O)[O-]
Structure:
CAS RN: 780026-07-5
CAS Name: sodium 2-aminoacetate
OPENEYE Name: sodium 2-aminoacetate
IUPAC Name: sodium 2-aminoacetate
SYSTEMATIC NAME: sodium 2-azanylethanoate
MOLECULAR FORMULA: C2H4NNaO2
MOLECULAR WEIGHT: 97.04843
SMILES: C(C(=O)[O-])N.[Na+]
Structure:
CAS RN: 51934-16-8
CAS Name: 3-methyl-2,8-dihydro-1H-pyrimido[5,4-e][1,2,4]triazine-5-thione
OPENEYE Name: 3-methyl-2,8-dihydro-1H-pyrimido[5,4-e][1,2,4]triazine-5-thione
IUPAC Name: 3-methyl-2,8-dihydro-1H-pyrimido[5,4-e][1,2,4]triazine-5-thione
SYSTEMATIC NAME: 3-methyl-2,8-dihydro-1H-pyrimido[5,4-e][1,2,4]triazine-5-thione
MOLECULAR FORMULA: C6H7N5S
MOLECULAR WEIGHT: 181.21828
SMILES: CC1=NC2=C(NC=NC2=S)NN1
Structure:
CAS RN: 59921-60-7
CAS Name: 3,5-dinitro-2-(7H-purin-6-ylthio)benzoic acid propyl ester
OPENEYE Name: propyl 3,5-dinitro-2-(7H-purin-6-ylsulfanyl)benzoate
IUPAC Name: propyl 3,5-dinitro-2-(7H-purin-6-ylsulfanyl)benzoate
SYSTEMATIC NAME: propyl 3,5-dinitro-2-(7H-purin-6-ylsulfanyl)benzoate
MOLECULAR FORMULA: C15H12N6O6S
MOLECULAR WEIGHT: 404.35738
SMILES: CCCOC(=O)C1=CC(=CC(=C1SC2=NC=NC3=C2NC=N3)[N+](=O)[O-])[N+](=O)[O-]
Structure:
CAS RN: 824-40-8
CAS Name: 1-oxido-2-pyridin-1-iumcarboxylate
OPENEYE Name: 1-oxidopyridin-1-ium-2-carboxylate
IUPAC Name: 1-oxidopyridin-1-ium-2-carboxylate
SYSTEMATIC NAME: 1-oxidanidylpyridin-1-ium-2-carboxylate
MOLECULAR FORMULA: C6H4NO3-
MOLECULAR WEIGHT: 138.10086
SMILES: C1=CC=[N+](C(=C1)C(=O)[O-])[O-]
Structure:
CAS RN: 7039-74-9
CAS Name: 2-bromo-1-(5-chloro-2-benzofuranyl)ethanone
OPENEYE Name: 2-bromo-1-(5-chlorobenzofuran-2-yl)ethanone
IUPAC Name: 2-bromo-1-(5-chloro-1-benzofuran-2-yl)ethanone
SYSTEMATIC NAME: 2-bromanyl-1-(5-chloranyl-1-benzofuran-2-yl)ethanone
MOLECULAR FORMULA: C10H6BrClO2
MOLECULAR WEIGHT: 273.51044
SMILES: C1=CC2=C(C=C1Cl)C=C(O2)C(=O)CBr
Structure:
CAS RN: 7147-57-1
CAS Name: [[propylamino(sulfanylidene)methyl]amino]urea
OPENEYE Name: (propylcarbamothioylamino)urea
IUPAC Name: (propylcarbamothioylamino)urea
SYSTEMATIC NAME: 1-(propylcarbamothioylamino)urea
MOLECULAR FORMULA: C5H12N4OS
MOLECULAR WEIGHT: 176.23998
SMILES: CCCNC(=S)NNC(=O)N
Structure:
CAS RN: 23550-40-5
CAS Name: 4-methyl-4-(methylthio)-2-pentanone
OPENEYE Name: 4-methyl-4-methylsulfanyl-pentan-2-one
IUPAC Name: 4-methyl-4-methylsulfanylpentan-2-one
SYSTEMATIC NAME: 4-methyl-4-methylsulfanyl-pentan-2-one
MOLECULAR FORMULA: C7H14OS
MOLECULAR WEIGHT: 146.25046
SMILES: CC(=O)CC(C)(C)SC
Structure:
CAS RN: 65929-03-5
CAS Name: 2-[[2-[[2-formamido-4-(methylthio)-1-oxobutyl]amino]-4-methyl-1-oxopentyl]amino]-3-phenylpropanoic acid methyl ester
OPENEYE Name: methyl 2-[[2-[(2-formamido-4-methylsulfanyl-butanoyl)amino]-4-methyl-pentanoyl]amino]-3-phenyl-propanoate
IUPAC Name: methyl 2-[[2-[(2-formamido-4-methylsulfanylbutanoyl)amino]-4-methylpentanoyl]amino]-3-phenylpropanoate
SYSTEMATIC NAME: methyl 2-[[2-[(2-formamido-4-methylsulfanyl-butanoyl)amino]-4-methyl-pentanoyl]amino]-3-phenyl-propanoate
MOLECULAR FORMULA: C22H33N3O5S
MOLECULAR WEIGHT: 451.57952
SMILES: CC(C)CC(C(=O)NC(CC1=CC=CC=C1)C(=O)OC)NC(=O)C(CCSC)NC=O
Structure:
CAS RN: 7514-46-7
CAS Name: 2-(1,12-dimethyl-5-benzo[c]phenanthrenyl)acetic acid
OPENEYE Name: 2-(1,12-dimethylbenzo[c]phenanthren-5-yl)acetic acid
IUPAC Name: 2-(1,12-dimethylbenzo[c]phenanthren-5-yl)acetic acid
SYSTEMATIC NAME: 2-(1,12-dimethylbenzo[c]phenanthren-5-yl)ethanoic acid
MOLECULAR FORMULA: C22H18O2
MOLECULAR WEIGHT: 314.37712
SMILES: CC1=CC=CC2=C1C3=C4C(=CC=CC4=C(C=C3C=C2)CC(=O)O)C
Structure:
CAS RN: 73413-78-2
CAS Name:
OPENEYE Name:
IUPAC Name:
SYSTEMATIC NAME:
MOLECULAR FORMULA: C45H57N13O15S
MOLECULAR WEIGHT: 1052.07718
SMILES: CC1C(=O)NC2CC3=C(NC4=CC=CC=C34)SCC(C(=O)N5CC(CC5C(=O)N1)O)NC(=O)C(NC(=O)C(NC(=O)C(NC2=O)CC(C)(CO)O)C(C)C)C(C(=O)NCCNC6=CC=C(C7=NON=C67)[N+](=O)[O-])O
Structure:
CAS RN: 758721-16-3
CAS Name: 5-(propoxymethyl)-2-furancarboxylic acid
OPENEYE Name: 5-(propoxymethyl)furan-2-carboxylic acid
IUPAC Name: 5-(propoxymethyl)furan-2-carboxylic acid
SYSTEMATIC NAME: 5-(propoxymethyl)furan-2-carboxylic acid
MOLECULAR FORMULA: C9H12O4
MOLECULAR WEIGHT: 184.18918
SMILES: CCCOCC1=CC=C(O1)C(=O)O
Structure:
CAS RN: 6898-84-6
CAS Name: sodium 1-propanethiolate
OPENEYE Name: sodium propane-1-thiolate
IUPAC Name: sodium propane-1-thiolate
SYSTEMATIC NAME: sodium propane-1-thiolate
MOLECULAR FORMULA: C3H7NaS
MOLECULAR WEIGHT: 98.14245
SMILES: CCC[S-].[Na+]
Structure:
CAS RN: 13721-20-5
CAS Name: 2-(3-chloro-4-methoxyphenyl)acetic acid
OPENEYE Name: 2-(3-chloro-4-methoxy-phenyl)acetic acid
IUPAC Name: 2-(3-chloro-4-methoxyphenyl)acetic acid
SYSTEMATIC NAME: 2-(3-chloranyl-4-methoxy-phenyl)ethanoic acid
MOLECULAR FORMULA: C9H9ClO3
MOLECULAR WEIGHT: 200.61896
SMILES: COC1=C(C=C(C=C1)CC(=O)O)Cl
Structure:
CAS RN: 6963-64-0
CAS Name: 5-nitro-1H-imidazole-4-thiol
OPENEYE Name: 5-nitro-1H-imidazole-4-thiol
IUPAC Name: 5-nitro-1H-imidazole-4-thiol
SYSTEMATIC NAME: 5-nitro-1H-imidazole-4-thiol
MOLECULAR FORMULA: C3H3N3O2S
MOLECULAR WEIGHT: 145.13982
SMILES: C1=NC(=C(N1)[N+](=O)[O-])S
Structure:
CAS RN: 90644-21-6
CAS Name: 2-[ethyl(7H-purin-6-yl)amino]ethanol
OPENEYE Name: 2-[ethyl(7H-purin-6-yl)amino]ethanol
IUPAC Name: 2-[ethyl(7H-purin-6-yl)amino]ethanol
SYSTEMATIC NAME: 2-[ethyl(7H-purin-6-yl)amino]ethanol
MOLECULAR FORMULA: C9H13N5O
MOLECULAR WEIGHT: 207.23242
SMILES: CCN(CCO)C1=NC=NC2=C1NC=N2
Structure:
CAS RN: 5731-82-8
CAS Name: 2-(1,3-dioxo-2-isoindolyl)-1,3-dioxo-N-(2-oxolanylmethyl)-5-isoindolecarboxamide
OPENEYE Name: 2-(1,3-dioxoisoindolin-2-yl)-1,3-dioxo-N-(tetrahydrofuran-2-ylmethyl)isoindoline-5-carboxamide
IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)-1,3-dioxo-N-(oxolan-2-ylmethyl)isoindole-5-carboxamide
SYSTEMATIC NAME: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-1,3-bis(oxidanylidene)-N-(oxolan-2-ylmethyl)isoindole-5-carboxamide
MOLECULAR FORMULA: C22H17N3O6
MOLECULAR WEIGHT: 419.38688
SMILES: C1CC(OC1)CNC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)N4C(=O)C5=CC=CC=C5C4=O
Structure:
CAS RN: 31349-29-8
CAS Name: 5-[(2-hydroxy-5-nitrophenyl)methyl]-4-oxo-2-sulfanylidene-1H-pyrimidine-6-carboxaldehyde
OPENEYE Name: 5-[(2-hydroxy-5-nitro-phenyl)methyl]-4-oxo-2-thioxo-1H-pyrimidine-6-carbaldehyde
IUPAC Name: 5-[(2-hydroxy-5-nitrophenyl)methyl]-4-oxo-2-sulfanylidene-1H-pyrimidine-6-carbaldehyde
SYSTEMATIC NAME: 5-[(5-nitro-2-oxidanyl-phenyl)methyl]-4-oxidanylidene-2-sulfanylidene-1H-pyrimidine-6-carbaldehyde
MOLECULAR FORMULA: C12H9N3O5S
MOLECULAR WEIGHT: 307.28196
SMILES: C1=CC(=C(C=C1[N+](=O)[O-])CC2=C(NC(=S)NC2=O)C=O)O
Structure:
CAS RN: 881189-65-7
CAS Name: 3-(4-chloro-3-fluorophenyl)propanoic acid
OPENEYE Name: 3-(4-chloro-3-fluoro-phenyl)propanoic acid
IUPAC Name: 3-(4-chloro-3-fluorophenyl)propanoic acid
SYSTEMATIC NAME: 3-(4-chloranyl-3-fluoranyl-phenyl)propanoic acid
MOLECULAR FORMULA: C9H8ClFO2
MOLECULAR WEIGHT: 202.610023
SMILES: C1=CC(=C(C=C1CCC(=O)O)F)Cl
Structure:
CAS RN: 588692-21-1
CAS Name: 2-[(2-chloro-4-fluorophenyl)methoxy]-3-methoxybenzaldehyde
OPENEYE Name: 2-[(2-chloro-4-fluoro-phenyl)methoxy]-3-methoxy-benzaldehyde
IUPAC Name: 2-[(2-chloro-4-fluorophenyl)methoxy]-3-methoxybenzaldehyde
SYSTEMATIC NAME: 2-[(2-chloranyl-4-fluoranyl-phenyl)methoxy]-3-methoxy-benzaldehyde
MOLECULAR FORMULA: C15H12ClFO3
MOLECULAR WEIGHT: 294.705383
SMILES: COC1=CC=CC(=C1OCC2=C(C=C(C=C2)F)Cl)C=O
Structure:
CAS RN: 77991-97-0
CAS Name: 1-cyclopropyl-3-phenylthiourea
OPENEYE Name: 1-cyclopropyl-3-phenyl-thiourea
IUPAC Name: 1-cyclopropyl-3-phenylthiourea
SYSTEMATIC NAME: 1-cyclopropyl-3-phenyl-thiourea
MOLECULAR FORMULA: C10H12N2S
MOLECULAR WEIGHT: 192.28068
SMILES: C1CC1NC(=S)NC2=CC=CC=C2
Structure:
CAS RN: 6358-09-4
CAS Name: 2-amino-6-chloro-4-nitrophenol
OPENEYE Name: 2-amino-6-chloro-4-nitro-phenol
IUPAC Name: 2-amino-6-chloro-4-nitrophenol
SYSTEMATIC NAME: 2-azanyl-6-chloranyl-4-nitro-phenol
MOLECULAR FORMULA: C6H5ClN2O3
MOLECULAR WEIGHT: 188.5685
SMILES: C1=C(C=C(C(=C1Cl)O)N)[N+](=O)[O-]
Structure:
CAS RN: 3470-50-6
CAS Name: 6-hydroxy-3,4-dihydro-2H-naphthalen-1-one
OPENEYE Name: 6-hydroxytetralin-1-one
IUPAC Name: 6-hydroxy-3,4-dihydro-2H-naphthalen-1-one
SYSTEMATIC NAME: 6-oxidanyl-3,4-dihydro-2H-naphthalen-1-one
MOLECULAR FORMULA: C10H10O2
MOLECULAR WEIGHT: 162.1852
SMILES: C1CC2=C(C=CC(=C2)O)C(=O)C1
Structure:
CAS RN: 16837-13-1
CAS Name: 6-amino-1-(4-iodophenyl)-2-sulfanylidene-4-pyrimidinone
OPENEYE Name: 6-amino-1-(4-iodophenyl)-2-thioxo-pyrimidin-4-one
IUPAC Name: 6-amino-1-(4-iodophenyl)-2-sulfanylidenepyrimidin-4-one
SYSTEMATIC NAME: 6-azanyl-1-(4-iodophenyl)-2-sulfanylidene-pyrimidin-4-one
MOLECULAR FORMULA: C10H8IN3OS
MOLECULAR WEIGHT: 345.15949
SMILES: C1=CC(=CC=C1N2C(=CC(=O)NC2=S)N)I
Structure:
CAS RN: 6639-34-5
CAS Name: 7-chloro-2-diazonio-4-methyl-3H-inden-1-olate
OPENEYE Name: 7-chloro-2-diazonio-4-methyl-3H-inden-1-olate
IUPAC Name: 7-chloro-2-diazonio-4-methyl-3H-inden-1-olate
SYSTEMATIC NAME: 7-chloranyl-2-diazonio-4-methyl-3H-inden-1-olate
MOLECULAR FORMULA: C10H7ClN2O
MOLECULAR WEIGHT: 206.62838
SMILES: CC1=C2CC(=C(C2=C(C=C1)Cl)[O-])[N+]#N
Structure:
CAS RN: 6003-94-7
CAS Name: 4-oxopyran-2,6-dicarboxylate
OPENEYE Name: 4-oxopyran-2,6-dicarboxylate
IUPAC Name: 4-oxopyran-2,6-dicarboxylate
SYSTEMATIC NAME: 4-oxidanylidenepyran-2,6-dicarboxylate
MOLECULAR FORMULA: C7H2O6-2
MOLECULAR WEIGHT: 182.08718
SMILES: C1=C(OC(=CC1=O)C(=O)[O-])C(=O)[O-]
Structure:
CAS RN: 379255-43-3
CAS Name: 2-chloro-N-cyclooctylacetamide
OPENEYE Name: 2-chloro-N-cyclooctyl-acetamide
IUPAC Name: 2-chloro-N-cyclooctylacetamide
SYSTEMATIC NAME: 2-chloranyl-N-cyclooctyl-ethanamide
MOLECULAR FORMULA: C10H18ClNO
MOLECULAR WEIGHT: 203.70902
SMILES: C1CCCC(CCC1)NC(=O)CCl
Structure:
CAS RN: 2069-32-1
CAS Name: 7-nitro-2-(trifluoromethyl)-10H-phenothiazine
OPENEYE Name: 7-nitro-2-(trifluoromethyl)-10H-phenothiazine
IUPAC Name: 7-nitro-2-(trifluoromethyl)-10H-phenothiazine
SYSTEMATIC NAME: 7-nitro-2-(trifluoromethyl)-10H-phenothiazine
MOLECULAR FORMULA: C13H7F3N2O2S
MOLECULAR WEIGHT: 312.26709
SMILES: C1=CC2=C(C=C1C(F)(F)F)NC3=C(S2)C=C(C=C3)[N+](=O)[O-]
Structure:
CAS RN: 50907-57-8
CAS Name: (2-chloro-6-nitrophenyl)methanol
OPENEYE Name: (2-chloro-6-nitro-phenyl)methanol
IUPAC Name: (2-chloro-6-nitrophenyl)methanol
SYSTEMATIC NAME: (2-chloranyl-6-nitro-phenyl)methanol
MOLECULAR FORMULA: C7H6ClNO3
MOLECULAR WEIGHT: 187.58044
SMILES: C1=CC(=C(C(=C1)Cl)CO)[N+](=O)[O-]
Structure:
CAS RN: 37046-17-6
CAS Name: 5H-pyrrolo[1,2-a]quinoxaline-4-thione
OPENEYE Name: 5H-pyrrolo[1,2-a]quinoxaline-4-thione
IUPAC Name: 5H-pyrrolo[1,2-a]quinoxaline-4-thione
SYSTEMATIC NAME: 5H-pyrrolo[1,2-a]quinoxaline-4-thione
MOLECULAR FORMULA: C11H8N2S
MOLECULAR WEIGHT: 200.25962
SMILES: C1=CC=C2C(=C1)NC(=S)C3=CC=CN23
Structure:
CAS RN: 6217-16-9
CAS Name: N-(2-benzo[g][1,3]benzothiazolyl)-4-fluorobenzamide
OPENEYE Name: N-benzo[g][1,3]benzothiazol-2-yl-4-fluoro-benzamide
IUPAC Name: N-benzo[g][1,3]benzothiazol-2-yl-4-fluorobenzamide
SYSTEMATIC NAME: N-benzo[g][1,3]benzothiazol-2-yl-4-fluoranyl-benzamide
MOLECULAR FORMULA: C18H11FN2OS
MOLECULAR WEIGHT: 322.356143
SMILES: C1=CC=C2C(=C1)C=CC3=C2SC(=N3)NC(=O)C4=CC=C(C=C4)F
Structure:
CAS RN: 6939-49-7
CAS Name: 4-methyl-5-oxo-3-sulfanylidene-2H-1,2,4-triazine-6-carboxylic acid ethyl ester
OPENEYE Name: ethyl 4-methyl-5-oxo-3-thioxo-2H-1,2,4-triazine-6-carboxylate
IUPAC Name: ethyl 4-methyl-5-oxo-3-sulfanylidene-2H-1,2,4-triazine-6-carboxylate
SYSTEMATIC NAME: ethyl 4-methyl-5-oxidanylidene-3-sulfanylidene-2H-1,2,4-triazine-6-carboxylate
MOLECULAR FORMULA: C7H9N3O3S
MOLECULAR WEIGHT: 215.22966
SMILES: CCOC(=O)C1=NNC(=S)N(C1=O)C
Structure:
CAS RN: 55310-46-8
CAS Name: sodium N,N-bis(phenylmethyl)carbamodithioate
OPENEYE Name: sodium N,N-dibenzylcarbamodithioate
IUPAC Name: sodium N,N-dibenzylcarbamodithioate
SYSTEMATIC NAME: sodium N,N-bis(phenylmethyl)carbamodithioate
MOLECULAR FORMULA: C15H14NNaS2
MOLECULAR WEIGHT: 295.39813
SMILES: C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C(=S)[S-].[Na+]
Structure:
CAS RN: 23933-23-5
CAS Name: thiocyanic acid [4-[[sulfanylidene-(4-thiocyanatoanilino)methyl]amino]phenyl] ester
OPENEYE Name: [4-[(4-thiocyanatophenyl)carbamothioylamino]phenyl] thiocyanate
IUPAC Name: [4-[(4-thiocyanatophenyl)carbamothioylamino]phenyl] thiocyanate
SYSTEMATIC NAME: [4-[(4-thiocyanatophenyl)carbamothioylamino]phenyl] thiocyanate
MOLECULAR FORMULA: C15H10N4S3
MOLECULAR WEIGHT: 342.4617
SMILES: C1=CC(=CC=C1NC(=S)NC2=CC=C(C=C2)SC#N)SC#N
Structure:
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