N-(4-acetamidophenyl)-2-[[5-(benzimidazol-1-ylmethyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(4-acetamidophenyl)-2-[[5-(benzimidazol-1-ylmethyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(4-acetamidophenyl)-2-[[5-(benzimidazol-1-ylmethyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(4-acetamidophenyl)-2-[[5-(1-benzimidazolylmethyl)-4-phenyl-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(4-acetamidophenyl)-2-[[5-(benzimidazol-1-ylmethyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(4-acetamidophenyl)-2-[[5-(benzimidazol-1-ylmethyl)-4-phenyl-1,2,4-triazol-3-yl]thio]acetamide Formula: C26H23N7O2S MolecularWeight: 497.57152

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C3=CC=CC=C3)CN4C=NC5=CC=CC=C54

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C3=CC=CC=C3)CN4C=NC5=CC=CC=C54

InChI

InChI=1S/C26H23N7O2S/c1-18(34)28-19-11-13-20(14-12-19)29-25(35)16-36-26-31-30-24(33(26)21-7-3-2-4-8-21)15-32-17-27-22-9-5-6-10-23(22)32/h2-14,17H,15-16H2,1H3,(H,28,34)(H,29,35)