3-methyl-1-(4-methylphenyl)-5-(4-methylsulfonylphenyl)-1,2,4-triazole

Systemtic Name: 3-methyl-1-(4-methylphenyl)-5-(4-methylsulfonylphenyl)-1,2,4-triazole Openeye Name: 3-methyl-5-(4-methylsulfonylphenyl)-1-(p-tolyl)-1,2,4-triazole CAS Name: 3-methyl-1-(4-methylphenyl)-5-(4-methylsulfonylphenyl)-1,2,4-triazole IUPAC Name: 3-methyl-1-(4-methylphenyl)-5-(4-methylsulfonylphenyl)-1,2,4-triazole Traditional Name: 5-(4-mesylphenyl)-3-methyl-1-(p-tolyl)-1,2,4-triazole Formula: C17H17N3O2S MolecularWeight: 327.40078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NC(=N2)C)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NC(=N2)C)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C17H17N3O2S/c1-12-4-8-15(9-5-12)20-17(18-13(2)19-20)14-6-10-16(11-7-14)23(3,21)22/h4-11H,1-3H3