N-[2-(2-methylbenzimidazol-1-yl)ethyl]-1-(3-methylsulfanylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: N-[2-(2-methylbenzimidazol-1-yl)ethyl]-1-(3-methylsulfanylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: N-[2-(2-methylbenzimidazol-1-yl)ethyl]-1-(3-methylsulfanylphenyl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: N-[2-(2-methyl-1-benzimidazolyl)ethyl]-1-[3-(methylthio)phenyl]-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: N-[2-(2-methylbenzimidazol-1-yl)ethyl]-1-(3-methylsulfanylphenyl)-5-oxopyrrolidine-3-carboxamide Traditional Name: 5-keto-N-[2-(2-methylbenzimidazol-1-yl)ethyl]-1-[3-(methylthio)phenyl]pyrrolidine-3-carboxamide Formula: C22H24N4O2S MolecularWeight: 408.51656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N1CCNC(=O)C3CC(=O)N(C3)C4=CC(=CC=C4)SC

Isomeric SMILES

CC1=NC2=CC=CC=C2N1CCNC(=O)C3CC(=O)N(C3)C4=CC(=CC=C4)SC

InChI

InChI=1S/C22H24N4O2S/c1-15-24-19-8-3-4-9-20(19)25(15)11-10-23-22(28)16-12-21(27)26(14-16)17-6-5-7-18(13-17)29-2/h3-9,13,16H,10-12,14H2,1-2H3,(H,23,28)