2-[2-(1-methylbenzimidazol-2-yl)sulfanylethanoyl-propyl-amino]-N-(2-methylphenyl)ethanamide

Systemtic Name: 2-[2-(1-methylbenzimidazol-2-yl)sulfanylethanoyl-propyl-amino]-N-(2-methylphenyl)ethanamide Openeye Name: 2-[[2-(1-methylbenzimidazol-2-yl)sulfanylacetyl]-propyl-amino]-N-(o-tolyl)acetamide CAS Name: 2-[[2-[(1-methyl-2-benzimidazolyl)thio]-1-oxoethyl]-propylamino]-N-(2-methylphenyl)acetamide IUPAC Name: 2-[[2-(1-methylbenzimidazol-2-yl)sulfanylacetyl]-propylamino]-N-(2-methylphenyl)acetamide Traditional Name: 2-[[2-[(1-methylbenzimidazol-2-yl)thio]acetyl]-propyl-amino]-N-(o-tolyl)acetamide Formula: C22H26N4O2S MolecularWeight: 410.53244

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC(=O)NC1=CC=CC=C1C)C(=O)CSC2=NC3=CC=CC=C3N2C

Isomeric SMILES

CCCN(CC(=O)NC1=CC=CC=C1C)C(=O)CSC2=NC3=CC=CC=C3N2C

InChI

InChI=1S/C22H26N4O2S/c1-4-13-26(14-20(27)23-17-10-6-5-9-16(17)2)21(28)15-29-22-24-18-11-7-8-12-19(18)25(22)3/h5-12H,4,13-15H2,1-3H3,(H,23,27)