2-[[4-(4-chlorophenyl)-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)ethanamide

Systemtic Name: 2-[[4-(4-chlorophenyl)-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)ethanamide Openeye Name: 2-[[5-benzyl-4-(4-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(1,3-dimethyl-2-oxo-benzimidazol-5-yl)acetamide CAS Name: 2-[[4-(4-chlorophenyl)-5-(phenylmethyl)-1,2,4-triazol-3-yl]thio]-N-(1,3-dimethyl-2-oxo-5-benzimidazolyl)acetamide IUPAC Name: 2-[[5-benzyl-4-(4-chlorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(1,3-dimethyl-2-oxobenzimidazol-5-yl)acetamide Traditional Name: 2-[[5-benzyl-4-(4-chlorophenyl)-1,2,4-triazol-3-yl]thio]-N-(2-keto-1,3-dimethyl-benzimidazol-5-yl)acetamide Formula: C26H23ClN6O2S MolecularWeight: 519.01782

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)NC(=O)CSC3=NN=C(N3C4=CC=C(C=C4)Cl)CC5=CC=CC=C5)N(C1=O)C

Isomeric SMILES

CN1C2=C(C=C(C=C2)NC(=O)CSC3=NN=C(N3C4=CC=C(C=C4)Cl)CC5=CC=CC=C5)N(C1=O)C

InChI

InChI=1S/C26H23ClN6O2S/c1-31-21-13-10-19(15-22(21)32(2)26(31)35)28-24(34)16-36-25-30-29-23(14-17-6-4-3-5-7-17)33(25)20-11-8-18(27)9-12-20/h3-13,15H,14,16H2,1-2H3,(H,28,34)