2-[[4-(4-chlorophenyl)-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-1-(4-phenylphenyl)ethylideneamino]ethanamide

Systemtic Name: 2-[[4-(4-chlorophenyl)-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-1-(4-phenylphenyl)ethylideneamino]ethanamide Openeye Name: 2-[[4-(4-chlorophenyl)-5-(p-tolyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-1-(4-phenylphenyl)ethylideneamino]acetamide CAS Name: 2-[[4-(4-chlorophenyl)-5-(4-methylphenyl)-1,2,4-triazol-3-yl]thio]-N-[(E)-1-(4-phenylphenyl)ethylideneamino]acetamide IUPAC Name: 2-[[4-(4-chlorophenyl)-5-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(E)-1-(4-phenylphenyl)ethylideneamino]acetamide Traditional Name: 2-[[4-(4-chlorophenyl)-5-(p-tolyl)-1,2,4-triazol-3-yl]thio]-N-[(E)-1-(4-phenylphenyl)ethylideneamino]acetamide Formula: C31H26ClN5OS MolecularWeight: 552.08904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)Cl)SCC(=O)NN=C(C)C4=CC=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)Cl)SCC(=O)N/N=C(\C)/C4=CC=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H26ClN5OS/c1-21-8-10-26(11-9-21)30-35-36-31(37(30)28-18-16-27(32)17-19-28)39-20-29(38)34-33-22(2)23-12-14-25(15-13-23)24-6-4-3-5-7-24/h3-19H,20H2,1-2H3,(H,34,38)/b33-22+