3-[4-(2,6-dimethylphenyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]-N,N-dimethyl-benzenesulfonamide

Systemtic Name: 3-[4-(2,6-dimethylphenyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]-N,N-dimethyl-benzenesulfonamide Openeye Name: 3-[4-(2,6-dimethylphenyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]-N,N-dimethyl-benzenesulfonamide CAS Name: 3-[4-(2,6-dimethylphenyl)-5-(methylthio)-1,2,4-triazol-3-yl]-N,N-dimethylbenzenesulfonamide IUPAC Name: 3-[4-(2,6-dimethylphenyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]-N,N-dimethylbenzenesulfonamide Traditional Name: 3-[4-(2,6-dimethylphenyl)-5-(methylthio)-1,2,4-triazol-3-yl]-N,N-dimethyl-benzenesulfonamide Formula: C19H22N4O2S2 MolecularWeight: 402.53358

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N2C(=NN=C2SC)C3=CC(=CC=C3)S(=O)(=O)N(C)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)N2C(=NN=C2SC)C3=CC(=CC=C3)S(=O)(=O)N(C)C

InChI

InChI=1S/C19H22N4O2S2/c1-13-8-6-9-14(2)17(13)23-18(20-21-19(23)26-5)15-10-7-11-16(12-15)27(24,25)22(3)4/h6-12H,1-5H3