diethyl 3-methyl-5-(2-pyrrolidin-1-ylcarbothioylsulfanylethanoylamino)thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 3-methyl-5-(2-pyrrolidin-1-ylcarbothioylsulfanylethanoylamino)thiophene-2,4-dicarboxylate Openeye Name: diethyl 3-methyl-5-[[2-(pyrrolidine-1-carbothioylsulfanyl)acetyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[1-oxo-2-[[1-pyrrolidinyl(sulfanylidene)methyl]thio]ethyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-methyl-5-[[2-(pyrrolidine-1-carbothioylsulfanyl)acetyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[[2-(pyrrolidine-1-carbothioylthio)acetyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester Formula: C18H24N2O5S3 MolecularWeight: 444.58856

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H24N2O5S3/c1-4-24-16(22)13-11(3)14(17(23)25-5-2)28-15(13)19-12(21)10-27-18(26)20-8-6-7-9-20/h4-10H2,1-3H3,(H,19,21)