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

Systemtic Name: 2-[[5-(3-chlorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2,5-dimethylphenyl)ethanamide Openeye Name: 2-[[5-(3-chlorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2,5-dimethylphenyl)acetamide CAS Name: 2-[[5-(3-chlorophenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]-N-(2,5-dimethylphenyl)acetamide IUPAC Name: 2-[[5-(3-chlorophenyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2,5-dimethylphenyl)acetamide Traditional Name: 2-[[5-(3-chlorophenyl)-4-phenyl-1,2,4-triazol-3-yl]thio]-N-(2,5-dimethylphenyl)acetamide Formula: C24H21ClN4OS MolecularWeight: 448.96774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC(=CC=C4)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C24H21ClN4OS/c1-16-11-12-17(2)21(13-16)26-22(30)15-31-24-28-27-23(18-7-6-8-19(25)14-18)29(24)20-9-4-3-5-10-20/h3-14H,15H2,1-2H3,(H,26,30)