3-[2-[1-(2-methylpropyl)benzimidazol-2-yl]sulfanylethanoyl-(phenylmethyl)amino]propanamide

Systemtic Name: 3-[2-[1-(2-methylpropyl)benzimidazol-2-yl]sulfanylethanoyl-(phenylmethyl)amino]propanamide Openeye Name: 3-[benzyl-[2-(1-isobutylbenzimidazol-2-yl)sulfanylacetyl]amino]propanamide CAS Name: 3-[[2-[[1-(2-methylpropyl)-2-benzimidazolyl]thio]-1-oxoethyl]-(phenylmethyl)amino]propanamide IUPAC Name: 3-[benzyl-[2-[1-(2-methylpropyl)benzimidazol-2-yl]sulfanylacetyl]amino]propanamide Traditional Name: 3-[benzyl-[2-[(1-isobutylbenzimidazol-2-yl)thio]acetyl]amino]propionamide Formula: C23H28N4O2S MolecularWeight: 424.55902

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=CC=CC=C2N=C1SCC(=O)N(CCC(=O)N)CC3=CC=CC=C3

Isomeric SMILES

CC(C)CN1C2=CC=CC=C2N=C1SCC(=O)N(CCC(=O)N)CC3=CC=CC=C3

InChI

InChI=1S/C23H28N4O2S/c1-17(2)14-27-20-11-7-6-10-19(20)25-23(27)30-16-22(29)26(13-12-21(24)28)15-18-8-4-3-5-9-18/h3-11,17H,12-16H2,1-2H3,(H2,24,28)