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

Systemtic Name: 4-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methylphenyl)butanamide Openeye Name: 4-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(p-tolyl)butanamide CAS Name: 4-[(4,5-diphenyl-1,2,4-triazol-3-yl)thio]-N-(4-methylphenyl)butanamide IUPAC Name: 4-[(4,5-diphenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methylphenyl)butanamide Traditional Name: 4-[(4,5-diphenyl-1,2,4-triazol-3-yl)thio]-N-(p-tolyl)butyramide Formula: C25H24N4OS MolecularWeight: 428.54926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CCCSC2=NN=C(N2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CCCSC2=NN=C(N2C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H24N4OS/c1-19-14-16-21(17-15-19)26-23(30)13-8-18-31-25-28-27-24(20-9-4-2-5-10-20)29(25)22-11-6-3-7-12-22/h2-7,9-12,14-17H,8,13,18H2,1H3,(H,26,30)