2-[2-(1H-benzimidazol-2-ylsulfanyl)ethanoyl-propyl-amino]-N-(2-methylphenyl)ethanamide

Systemtic Name: 2-[2-(1H-benzimidazol-2-ylsulfanyl)ethanoyl-propyl-amino]-N-(2-methylphenyl)ethanamide Openeye Name: 2-[[2-(1H-benzimidazol-2-ylsulfanyl)acetyl]-propyl-amino]-N-(o-tolyl)acetamide CAS Name: 2-[[2-(1H-benzimidazol-2-ylthio)-1-oxoethyl]-propylamino]-N-(2-methylphenyl)acetamide IUPAC Name: 2-[[2-(1H-benzimidazol-2-ylsulfanyl)acetyl]-propylamino]-N-(2-methylphenyl)acetamide Traditional Name: 2-[[2-(1H-benzimidazol-2-ylthio)acetyl]-propyl-amino]-N-(o-tolyl)acetamide Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC(=O)NC1=CC=CC=C1C)C(=O)CSC2=NC3=CC=CC=C3N2

Isomeric SMILES

CCCN(CC(=O)NC1=CC=CC=C1C)C(=O)CSC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C21H24N4O2S/c1-3-12-25(13-19(26)22-16-9-5-4-8-15(16)2)20(27)14-28-21-23-17-10-6-7-11-18(17)24-21/h4-11H,3,12-14H2,1-2H3,(H,22,26)(H,23,24)