ethyl 5-ethanoyl-4-methyl-2-(2-pyrrolidin-1-ylcarbothioylsulfanylethanoylamino)thiophene-3-carboxylate

Systemtic Name: ethyl 5-ethanoyl-4-methyl-2-(2-pyrrolidin-1-ylcarbothioylsulfanylethanoylamino)thiophene-3-carboxylate Openeye Name: ethyl 5-acetyl-4-methyl-2-[[2-(pyrrolidine-1-carbothioylsulfanyl)acetyl]amino]thiophene-3-carboxylate CAS Name: 5-acetyl-4-methyl-2-[[1-oxo-2-[[1-pyrrolidinyl(sulfanylidene)methyl]thio]ethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-acetyl-4-methyl-2-[[2-(pyrrolidine-1-carbothioylsulfanyl)acetyl]amino]thiophene-3-carboxylate Traditional Name: 5-acetyl-4-methyl-2-[[2-(pyrrolidine-1-carbothioylthio)acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C17H22N2O4S3 MolecularWeight: 414.56258

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)CSC(=S)N2CCCC2

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)C)NC(=O)CSC(=S)N2CCCC2

InChI

InChI=1S/C17H22N2O4S3/c1-4-23-16(22)13-10(2)14(11(3)20)26-15(13)18-12(21)9-25-17(24)19-7-5-6-8-19/h4-9H2,1-3H3,(H,18,21)