2-[2-(4-methylsulfonylphenyl)-5-(trifluoromethyl)-1,2,4-triazol-3-yl]quinoline

Systemtic Name: 2-[2-(4-methylsulfonylphenyl)-5-(trifluoromethyl)-1,2,4-triazol-3-yl]quinoline Openeye Name: 2-[2-(4-methylsulfonylphenyl)-5-(trifluoromethyl)-1,2,4-triazol-3-yl]quinoline CAS Name: 2-[2-(4-methylsulfonylphenyl)-5-(trifluoromethyl)-1,2,4-triazol-3-yl]quinoline IUPAC Name: 2-[2-(4-methylsulfonylphenyl)-5-(trifluoromethyl)-1,2,4-triazol-3-yl]quinoline Traditional Name: 2-[2-(4-mesylphenyl)-5-(trifluoromethyl)-1,2,4-triazol-3-yl]quinoline Formula: C19H13F3N4O2S MolecularWeight: 418.39233

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)N2C(=NC(=N2)C(F)(F)F)C3=NC4=CC=CC=C4C=C3

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)N2C(=NC(=N2)C(F)(F)F)C3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C19H13F3N4O2S/c1-29(27,28)14-9-7-13(8-10-14)26-17(24-18(25-26)19(20,21)22)16-11-6-12-4-2-3-5-15(12)23-16/h2-11H,1H3