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

Systemtic Name: N-(4-methylphenyl)-4-[[5-(4-methylphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]butanamide Openeye Name: 4-[[4-phenyl-5-(p-tolyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(p-tolyl)butanamide CAS Name: N-(4-methylphenyl)-4-[[5-(4-methylphenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]butanamide IUPAC Name: N-(4-methylphenyl)-4-[[5-(4-methylphenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]butanamide Traditional Name: 4-[[4-phenyl-5-(p-tolyl)-1,2,4-triazol-3-yl]thio]-N-(p-tolyl)butyramide Formula: C26H26N4OS MolecularWeight: 442.57584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)SCCCC(=O)NC4=CC=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)SCCCC(=O)NC4=CC=C(C=C4)C

InChI

InChI=1S/C26H26N4OS/c1-19-10-14-21(15-11-19)25-28-29-26(30(25)23-7-4-3-5-8-23)32-18-6-9-24(31)27-22-16-12-20(2)13-17-22/h3-5,7-8,10-17H,6,9,18H2,1-2H3,(H,27,31)