diethyl 3-methyl-5-[2-[2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanylphenyl]carbonyloxyethanoylamino]thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 3-methyl-5-[2-[2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanylphenyl]carbonyloxyethanoylamino]thiophene-2,4-dicarboxylate Openeye Name: diethyl 3-methyl-5-[[2-[2-(2-oxo-2-pyrrolidin-1-yl-ethyl)sulfanylbenzoyl]oxyacetyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[1-oxo-2-[oxo-[2-[[2-oxo-2-(1-pyrrolidinyl)ethyl]thio]phenyl]methoxy]ethyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-methyl-5-[[2-[2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanylbenzoyl]oxyacetyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 5-[[2-[2-[(2-keto-2-pyrrolidino-ethyl)thio]benzoyl]oxyacetyl]amino]-3-methyl-thiophene-2,4-dicarboxylic acid diethyl ester Formula: C26H30N2O8S2 MolecularWeight: 562.655

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)COC(=O)C2=CC=CC=C2SCC(=O)N3CCCC3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)COC(=O)C2=CC=CC=C2SCC(=O)N3CCCC3

InChI

InChI=1S/C26H30N2O8S2/c1-4-34-25(32)21-16(3)22(26(33)35-5-2)38-23(21)27-19(29)14-36-24(31)17-10-6-7-11-18(17)37-15-20(30)28-12-8-9-13-28/h6-7,10-11H,4-5,8-9,12-15H2,1-3H3,(H,27,29)