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

Systemtic Name: 2-[[5-(4-aminophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylphenyl)propanamide Openeye Name: 2-[[5-(4-aminophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(o-tolyl)propanamide CAS Name: 2-[[5-(4-aminophenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]-N-(2-methylphenyl)propanamide IUPAC Name: 2-[[5-(4-aminophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylphenyl)propanamide Traditional Name: 2-[[5-(4-aminophenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]-N-(o-tolyl)propionamide Formula: C24H23N5OS MolecularWeight: 429.53732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C(C)SC2=NN=C(N2C3=CC=CC=C3)C4=CC=C(C=C4)N

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C(C)SC2=NN=C(N2C3=CC=CC=C3)C4=CC=C(C=C4)N

InChI

InChI=1S/C24H23N5OS/c1-16-8-6-7-11-21(16)26-23(30)17(2)31-24-28-27-22(18-12-14-19(25)15-13-18)29(24)20-9-4-3-5-10-20/h3-15,17H,25H2,1-2H3,(H,26,30)