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

Systemtic Name: N-butyl-1-(4-methylsulfanylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: N-butyl-1-(4-methylsulfanylphenyl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: N-butyl-1-[4-(methylthio)phenyl]-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: N-butyl-1-(4-methylsulfanylphenyl)-5-oxopyrrolidine-3-carboxamide Traditional Name: N-butyl-5-keto-1-[4-(methylthio)phenyl]pyrrolidine-3-carboxamide Formula: C16H22N2O2S MolecularWeight: 306.42308

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1CC(=O)N(C1)C2=CC=C(C=C2)SC

Isomeric SMILES

CCCCNC(=O)C1CC(=O)N(C1)C2=CC=C(C=C2)SC

InChI

InChI=1S/C16H22N2O2S/c1-3-4-9-17-16(20)12-10-15(19)18(11-12)13-5-7-14(21-2)8-6-13/h5-8,12H,3-4,9-11H2,1-2H3,(H,17,20)