N-[2-(4-chlorophenyl)ethyl]-1-(3-methylsulfanylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: N-[2-(4-chlorophenyl)ethyl]-1-(3-methylsulfanylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: N-[2-(4-chlorophenyl)ethyl]-1-(3-methylsulfanylphenyl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: N-[2-(4-chlorophenyl)ethyl]-1-[3-(methylthio)phenyl]-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: N-[2-(4-chlorophenyl)ethyl]-1-(3-methylsulfanylphenyl)-5-oxopyrrolidine-3-carboxamide Traditional Name: N-[2-(4-chlorophenyl)ethyl]-5-keto-1-[3-(methylthio)phenyl]pyrrolidine-3-carboxamide Formula: C20H21ClN2O2S MolecularWeight: 388.91094

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)N2CC(CC2=O)C(=O)NCCC3=CC=C(C=C3)Cl

Isomeric SMILES

CSC1=CC=CC(=C1)N2CC(CC2=O)C(=O)NCCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H21ClN2O2S/c1-26-18-4-2-3-17(12-18)23-13-15(11-19(23)24)20(25)22-10-9-14-5-7-16(21)8-6-14/h2-8,12,15H,9-11,13H2,1H3,(H,22,25)