2-quinolin-2-ylsulfanyl-N-[2-(1,2,4-triazol-1-yl)-5-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: 2-quinolin-2-ylsulfanyl-N-[2-(1,2,4-triazol-1-yl)-5-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-(2-quinolylsulfanyl)-N-[2-(1,2,4-triazol-1-yl)-5-(trifluoromethyl)phenyl]acetamide CAS Name: 2-(2-quinolinylthio)-N-[2-(1,2,4-triazol-1-yl)-5-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-quinolin-2-ylsulfanyl-N-[2-(1,2,4-triazol-1-yl)-5-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-(2-quinolylthio)-N-[2-(1,2,4-triazol-1-yl)-5-(trifluoromethyl)phenyl]acetamide Formula: C20H14F3N5OS MolecularWeight: 429.41827

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)SCC(=O)NC3=C(C=CC(=C3)C(F)(F)F)N4C=NC=N4

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)SCC(=O)NC3=C(C=CC(=C3)C(F)(F)F)N4C=NC=N4

InChI

InChI=1S/C20H14F3N5OS/c21-20(22,23)14-6-7-17(28-12-24-11-25-28)16(9-14)26-18(29)10-30-19-8-5-13-3-1-2-4-15(13)27-19/h1-9,11-12H,10H2,(H,26,29)