2-[[5-(4-methylphenyl)-4-naphthalen-1-yl-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-ethanamide

Systemtic Name: 2-[[5-(4-methylphenyl)-4-naphthalen-1-yl-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-ethanamide Openeye Name: 2-[[4-(1-naphthyl)-5-(p-tolyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-acetamide CAS Name: 2-[[5-(4-methylphenyl)-4-(1-naphthalenyl)-1,2,4-triazol-3-yl]thio]-N-phenylacetamide IUPAC Name: 2-[[5-(4-methylphenyl)-4-naphthalen-1-yl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide Traditional Name: 2-[[4-(1-naphthyl)-5-(p-tolyl)-1,2,4-triazol-3-yl]thio]-N-phenyl-acetamide Formula: C27H22N4OS MolecularWeight: 450.55478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC4=CC=CC=C43)SCC(=O)NC5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC4=CC=CC=C43)SCC(=O)NC5=CC=CC=C5

InChI

InChI=1S/C27H22N4OS/c1-19-14-16-21(17-15-19)26-29-30-27(33-18-25(32)28-22-10-3-2-4-11-22)31(26)24-13-7-9-20-8-5-6-12-23(20)24/h2-17H,18H2,1H3,(H,28,32)