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

Systemtic Name: 2-[[5-(4-acetamidophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylphenyl)ethanamide Openeye Name: 2-[[5-(4-acetamidophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(o-tolyl)acetamide CAS Name: 2-[[5-(4-acetamidophenyl)-1H-1,2,4-triazol-3-yl]thio]-N-(2-methylphenyl)acetamide IUPAC Name: 2-[[5-(4-acetamidophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methylphenyl)acetamide Traditional Name: 2-[[5-(4-acetamidophenyl)-1H-1,2,4-triazol-3-yl]thio]-N-(o-tolyl)acetamide Formula: C19H19N5O2S MolecularWeight: 381.45146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)CSC2=NNC(=N2)C3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

CC1=CC=CC=C1NC(=O)CSC2=NNC(=N2)C3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C19H19N5O2S/c1-12-5-3-4-6-16(12)21-17(26)11-27-19-22-18(23-24-19)14-7-9-15(10-8-14)20-13(2)25/h3-10H,11H2,1-2H3,(H,20,25)(H,21,26)(H,22,23,24)