2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[4-(trifluoromethyloxy)phenyl]ethanamide

Systemtic Name: 2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[4-(trifluoromethyloxy)phenyl]ethanamide Openeye Name: 2-[[5-(4-pyridyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-[4-(trifluoromethoxy)phenyl]acetamide CAS Name: 2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)thio]-N-[4-(trifluoromethoxy)phenyl]acetamide IUPAC Name: 2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[4-(trifluoromethoxy)phenyl]acetamide Traditional Name: 2-[[5-(4-pyridyl)-1H-1,2,4-triazol-3-yl]thio]-N-[4-(trifluoromethoxy)phenyl]acetamide Formula: C16H12F3N5O2S MolecularWeight: 395.35899

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)CSC2=NNC(=N2)C3=CC=NC=C3)OC(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1NC(=O)CSC2=NNC(=N2)C3=CC=NC=C3)OC(F)(F)F

InChI

InChI=1S/C16H12F3N5O2S/c17-16(18,19)26-12-3-1-11(2-4-12)21-13(25)9-27-15-22-14(23-24-15)10-5-7-20-8-6-10/h1-8H,9H2,(H,21,25)(H,22,23,24)