dimethyl 5-azanyl-3-[[2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanylphenyl]carbonyloxymethyl]thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 5-azanyl-3-[[2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanylphenyl]carbonyloxymethyl]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-amino-3-[[2-(2-oxo-2-pyrrolidin-1-yl-ethyl)sulfanylbenzoyl]oxymethyl]thiophene-2,4-dicarboxylate CAS Name: 5-amino-3-[[oxo-[2-[[2-oxo-2-(1-pyrrolidinyl)ethyl]thio]phenyl]methoxy]methyl]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-amino-3-[[2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanylbenzoyl]oxymethyl]thiophene-2,4-dicarboxylate Traditional Name: 5-amino-3-[[2-[(2-keto-2-pyrrolidino-ethyl)thio]benzoyl]oxymethyl]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C22H24N2O7S2 MolecularWeight: 492.56516

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC(=C1COC(=O)C2=CC=CC=C2SCC(=O)N3CCCC3)C(=O)OC)N

Isomeric SMILES

COC(=O)C1=C(SC(=C1COC(=O)C2=CC=CC=C2SCC(=O)N3CCCC3)C(=O)OC)N

InChI

InChI=1S/C22H24N2O7S2/c1-29-21(27)17-14(18(22(28)30-2)33-19(17)23)11-31-20(26)13-7-3-4-8-15(13)32-12-16(25)24-9-5-6-10-24/h3-4,7-8H,5-6,9-12,23H2,1-2H3