1-(3-methylsulfanylphenyl)-5-oxidanylidene-N-(4-propylphenyl)pyrrolidine-3-carboxamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)NC(=O)C2CC(=O)N(C2)C3=CC(=CC=C3)SC

Isomeric SMILES

CCCC1=CC=C(C=C1)NC(=O)C2CC(=O)N(C2)C3=CC(=CC=C3)SC

InChI

InChI=1S/C21H24N2O2S/c1-3-5-15-8-10-17(11-9-15)22-21(25)16-12-20(24)23(14-16)18-6-4-7-19(13-18)26-2/h4,6-11,13,16H,3,5,12,14H2,1-2H3,(H,22,25)