1-(1,3-benzodioxol-5-yl)-N-methyl-N-[(4-methylsulfanylphenyl)methyl]-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-N-methyl-N-[(4-methylsulfanylphenyl)methyl]-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: 1-(1,3-benzodioxol-5-yl)-N-methyl-N-[(4-methylsulfanylphenyl)methyl]-5-oxo-pyrrolidine-3-carboxamide CAS Name: 1-(1,3-benzodioxol-5-yl)-N-methyl-N-[[4-(methylthio)phenyl]methyl]-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: 1-(1,3-benzodioxol-5-yl)-N-methyl-N-[(4-methylsulfanylphenyl)methyl]-5-oxopyrrolidine-3-carboxamide Traditional Name: 1-(1,3-benzodioxol-5-yl)-5-keto-N-methyl-N-[4-(methylthio)benzyl]pyrrolidine-3-carboxamide Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)SC)C(=O)C2CC(=O)N(C2)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CN(CC1=CC=C(C=C1)SC)C(=O)C2CC(=O)N(C2)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H22N2O4S/c1-22(11-14-3-6-17(28-2)7-4-14)21(25)15-9-20(24)23(12-15)16-5-8-18-19(10-16)27-13-26-18/h3-8,10,15H,9,11-13H2,1-2H3