N-[2-(2-methoxy-5-methyl-phenyl)ethyl]-1-(3-methylsulfanylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: N-[2-(2-methoxy-5-methyl-phenyl)ethyl]-1-(3-methylsulfanylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: N-[2-(2-methoxy-5-methyl-phenyl)ethyl]-1-(3-methylsulfanylphenyl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: N-[2-(2-methoxy-5-methylphenyl)ethyl]-1-[3-(methylthio)phenyl]-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: N-[2-(2-methoxy-5-methylphenyl)ethyl]-1-(3-methylsulfanylphenyl)-5-oxopyrrolidine-3-carboxamide Traditional Name: 5-keto-N-[2-(2-methoxy-5-methyl-phenyl)ethyl]-1-[3-(methylthio)phenyl]pyrrolidine-3-carboxamide Formula: C22H26N2O3S MolecularWeight: 398.51844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)CCNC(=O)C2CC(=O)N(C2)C3=CC(=CC=C3)SC

Isomeric SMILES

CC1=CC(=C(C=C1)OC)CCNC(=O)C2CC(=O)N(C2)C3=CC(=CC=C3)SC

InChI

InChI=1S/C22H26N2O3S/c1-15-7-8-20(27-2)16(11-15)9-10-23-22(26)17-12-21(25)24(14-17)18-5-4-6-19(13-18)28-3/h4-8,11,13,17H,9-10,12,14H2,1-3H3,(H,23,26)