2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-5-(trifluoromethyl)pyridine

Systemtic Name: 2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-5-(trifluoromethyl)pyridine Openeye Name: 2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-5-(trifluoromethyl)pyridine CAS Name: 2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)thio]-5-(trifluoromethyl)pyridine IUPAC Name: 2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-5-(trifluoromethyl)pyridine Traditional Name: 2-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)thio]-5-(trifluoromethyl)pyridine Formula: C15H11F3N4S MolecularWeight: 336.33485

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SC2=NC=C(C=C2)C(F)(F)F)C3=CC=CC=C3

Isomeric SMILES

CN1C(=NN=C1SC2=NC=C(C=C2)C(F)(F)F)C3=CC=CC=C3

InChI

InChI=1S/C15H11F3N4S/c1-22-13(10-5-3-2-4-6-10)20-21-14(22)23-12-8-7-11(9-19-12)15(16,17)18/h2-9H,1H3