(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl) 4-[(4-chlorophenyl)sulfanylmethyl]benzoate

Systemtic Name: (2-oxidanylidene-2-pyrrolidin-1-yl-ethyl) 4-[(4-chlorophenyl)sulfanylmethyl]benzoate Openeye Name: (2-oxo-2-pyrrolidin-1-yl-ethyl) 4-[(4-chlorophenyl)sulfanylmethyl]benzoate CAS Name: 4-[[(4-chlorophenyl)thio]methyl]benzoic acid [2-oxo-2-(1-pyrrolidinyl)ethyl] ester IUPAC Name: (2-oxo-2-pyrrolidin-1-ylethyl) 4-[(4-chlorophenyl)sulfanylmethyl]benzoate Traditional Name: 4-[[(4-chlorophenyl)thio]methyl]benzoic acid (2-keto-2-pyrrolidino-ethyl) ester Formula: C20H20ClNO3S MolecularWeight: 389.8957

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)COC(=O)C2=CC=C(C=C2)CSC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCN(C1)C(=O)COC(=O)C2=CC=C(C=C2)CSC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H20ClNO3S/c21-17-7-9-18(10-8-17)26-14-15-3-5-16(6-4-15)20(24)25-13-19(23)22-11-1-2-12-22/h3-10H,1-2,11-14H2