methyl 1-[4-[(4-chlorophenyl)sulfanylmethyl]phenyl]carbonylpyrrolidine-2-carboxylate

Systemtic Name: methyl 1-[4-[(4-chlorophenyl)sulfanylmethyl]phenyl]carbonylpyrrolidine-2-carboxylate Openeye Name: methyl 1-[4-[(4-chlorophenyl)sulfanylmethyl]benzoyl]pyrrolidine-2-carboxylate CAS Name: 1-[[4-[[(4-chlorophenyl)thio]methyl]phenyl]-oxomethyl]-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[4-[(4-chlorophenyl)sulfanylmethyl]benzoyl]pyrrolidine-2-carboxylate Traditional Name: 1-[4-[[(4-chlorophenyl)thio]methyl]benzoyl]pyrrolidine-2-carboxylic acid methyl ester Formula: C20H20ClNO3S MolecularWeight: 389.8957

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCCN1C(=O)C2=CC=C(C=C2)CSC3=CC=C(C=C3)Cl

Isomeric SMILES

COC(=O)C1CCCN1C(=O)C2=CC=C(C=C2)CSC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H20ClNO3S/c1-25-20(24)18-3-2-12-22(18)19(23)15-6-4-14(5-7-15)13-26-17-10-8-16(21)9-11-17/h4-11,18H,2-3,12-13H2,1H3