ethyl 2-[[5-ethanoyl-4-methyl-2-(2-oxidanylidenepropylsulfanyl)thiophen-3-yl]carbonylamino]-5,5-dimethyl-7-oxidanylidene-4,6-dihydro-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-[[5-ethanoyl-4-methyl-2-(2-oxidanylidenepropylsulfanyl)thiophen-3-yl]carbonylamino]-5,5-dimethyl-7-oxidanylidene-4,6-dihydro-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-[(2-acetonylsulfanyl-5-acetyl-4-methyl-thiophene-3-carbonyl)amino]-5,5-dimethyl-7-oxo-4,6-dihydrobenzothiophene-3-carboxylate CAS Name: 2-[[[5-acetyl-4-methyl-2-(2-oxopropylthio)-3-thiophenyl]-oxomethyl]amino]-5,5-dimethyl-7-oxo-4,6-dihydro-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[[5-acetyl-4-methyl-2-(2-oxopropylsulfanyl)thiophene-3-carbonyl]amino]-5,5-dimethyl-7-oxo-4,6-dihydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[[2-(acetonylthio)-5-acetyl-4-methyl-thiophene-3-carbonyl]amino]-7-keto-5,5-dimethyl-4,6-dihydrobenzothiophene-3-carboxylic acid ethyl ester Formula: C24H27NO6S3 MolecularWeight: 521.66928

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CC(CC2=O)(C)C)NC(=O)C3=C(SC(=C3C)C(=O)C)SCC(=O)C

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CC(CC2=O)(C)C)NC(=O)C3=C(SC(=C3C)C(=O)C)SCC(=O)C

InChI

InChI=1S/C24H27NO6S3/c1-7-31-22(30)17-14-8-24(5,6)9-15(28)19(14)33-21(17)25-20(29)16-12(3)18(13(4)27)34-23(16)32-10-11(2)26/h7-10H2,1-6H3,(H,25,29)