N-(2-ethyl-6-methyl-phenyl)-1-(4-methylsulfanylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: N-(2-ethyl-6-methyl-phenyl)-1-(4-methylsulfanylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: N-(2-ethyl-6-methyl-phenyl)-1-(4-methylsulfanylphenyl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: N-(2-ethyl-6-methylphenyl)-1-[4-(methylthio)phenyl]-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: N-(2-ethyl-6-methylphenyl)-1-(4-methylsulfanylphenyl)-5-oxopyrrolidine-3-carboxamide Traditional Name: N-(2-ethyl-6-methyl-phenyl)-5-keto-1-[4-(methylthio)phenyl]pyrrolidine-3-carboxamide Formula: C21H24N2O2S MolecularWeight: 368.49246

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)C2CC(=O)N(C2)C3=CC=C(C=C3)SC)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)C2CC(=O)N(C2)C3=CC=C(C=C3)SC)C

InChI

InChI=1S/C21H24N2O2S/c1-4-15-7-5-6-14(2)20(15)22-21(25)16-12-19(24)23(13-16)17-8-10-18(26-3)11-9-17/h5-11,16H,4,12-13H2,1-3H3,(H,22,25)