methyl 3-[2-[2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanylphenyl]carbonyloxyethanoylamino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[2-[2-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)sulfanylphenyl]carbonyloxyethanoylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[[2-[2-(2-oxo-2-pyrrolidin-1-yl-ethyl)sulfanylbenzoyl]oxyacetyl]amino]thiophene-2-carboxylate CAS Name: 3-[[1-oxo-2-[oxo-[2-[[2-oxo-2-(1-pyrrolidinyl)ethyl]thio]phenyl]methoxy]ethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[2-[2-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanylbenzoyl]oxyacetyl]amino]thiophene-2-carboxylate Traditional Name: 3-[[2-[2-[(2-keto-2-pyrrolidino-ethyl)thio]benzoyl]oxyacetyl]amino]thiophene-2-carboxylic acid methyl ester Formula: C21H22N2O6S2 MolecularWeight: 462.53918

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)NC(=O)COC(=O)C2=CC=CC=C2SCC(=O)N3CCCC3

Isomeric SMILES

COC(=O)C1=C(C=CS1)NC(=O)COC(=O)C2=CC=CC=C2SCC(=O)N3CCCC3

InChI

InChI=1S/C21H22N2O6S2/c1-28-21(27)19-15(8-11-30-19)22-17(24)12-29-20(26)14-6-2-3-7-16(14)31-13-18(25)23-9-4-5-10-23/h2-3,6-8,11H,4-5,9-10,12-13H2,1H3,(H,22,24)