(2S)-N-(4-acetamidophenyl)-2-[1-(4-methylphenyl)benzimidazol-2-yl]sulfanyl-propanamide

Systemtic Name: (2S)-N-(4-acetamidophenyl)-2-[1-(4-methylphenyl)benzimidazol-2-yl]sulfanyl-propanamide Openeye Name: (2S)-N-(4-acetamidophenyl)-2-[1-(p-tolyl)benzimidazol-2-yl]sulfanyl-propanamide CAS Name: (2S)-N-(4-acetamidophenyl)-2-[[1-(4-methylphenyl)-2-benzimidazolyl]thio]propanamide IUPAC Name: (2S)-N-(4-acetamidophenyl)-2-[1-(4-methylphenyl)benzimidazol-2-yl]sulfanylpropanamide Traditional Name: (2S)-N-(4-acetamidophenyl)-2-[[1-(p-tolyl)benzimidazol-2-yl]thio]propionamide Formula: C25H24N4O2S MolecularWeight: 444.54866

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C3=CC=CC=C3N=C2SC(C)C(=O)NC4=CC=C(C=C4)NC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C3=CC=CC=C3N=C2S[C@@H](C)C(=O)NC4=CC=C(C=C4)NC(=O)C

InChI

InChI=1S/C25H24N4O2S/c1-16-8-14-21(15-9-16)29-23-7-5-4-6-22(23)28-25(29)32-17(2)24(31)27-20-12-10-19(11-13-20)26-18(3)30/h4-15,17H,1-3H3,(H,26,30)(H,27,31)/t17-/m0/s1