N-[3-methyl-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-3-(methylsulfanylmethyl)-1-benzofuran-2-carboxamide

Systemtic Name: N-[3-methyl-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-3-(methylsulfanylmethyl)-1-benzofuran-2-carboxamide Openeye Name: N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]-3-(methylsulfanylmethyl)benzofuran-2-carboxamide CAS Name: N-[3-methyl-4-(2-oxo-1-pyrrolidinyl)phenyl]-3-[(methylthio)methyl]-2-benzofurancarboxamide IUPAC Name: N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]-3-(methylsulfanylmethyl)-1-benzofuran-2-carboxamide Traditional Name: N-[4-(2-ketopyrrolidino)-3-methyl-phenyl]-3-[(methylthio)methyl]coumarilamide Formula: C22H22N2O3S MolecularWeight: 394.48668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C2=C(C3=CC=CC=C3O2)CSC)N4CCCC4=O

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C2=C(C3=CC=CC=C3O2)CSC)N4CCCC4=O

InChI

InChI=1S/C22H22N2O3S/c1-14-12-15(9-10-18(14)24-11-5-8-20(24)25)23-22(26)21-17(13-28-2)16-6-3-4-7-19(16)27-21/h3-4,6-7,9-10,12H,5,8,11,13H2,1-2H3,(H,23,26)