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

Systemtic Name: N-[3-[4-phenyl-5-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-1,2,4-triazol-3-yl]propyl]ethanamide Openeye Name: N-[3-[4-phenyl-5-[[5-(trifluoromethyl)-2-pyridyl]sulfanyl]-1,2,4-triazol-3-yl]propyl]acetamide CAS Name: N-[3-[4-phenyl-5-[[5-(trifluoromethyl)-2-pyridinyl]thio]-1,2,4-triazol-3-yl]propyl]acetamide IUPAC Name: N-[3-[4-phenyl-5-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-1,2,4-triazol-3-yl]propyl]acetamide Traditional Name: N-[3-[4-phenyl-5-[[5-(trifluoromethyl)-2-pyridyl]thio]-1,2,4-triazol-3-yl]propyl]acetamide Formula: C19H18F3N5OS MolecularWeight: 421.43933

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCCC1=NN=C(N1C2=CC=CC=C2)SC3=NC=C(C=C3)C(F)(F)F

Isomeric SMILES

CC(=O)NCCCC1=NN=C(N1C2=CC=CC=C2)SC3=NC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C19H18F3N5OS/c1-13(28)23-11-5-8-16-25-26-18(27(16)15-6-3-2-4-7-15)29-17-10-9-14(12-24-17)19(20,21)22/h2-4,6-7,9-10,12H,5,8,11H2,1H3,(H,23,28)