1-phenyl-1-[2-sulfanyl-1-(trifluoromethyl)cyclopropyl]-2-(1,2,4-triazol-1-yl)ethanol

Systemtic Name: 1-phenyl-1-[2-sulfanyl-1-(trifluoromethyl)cyclopropyl]-2-(1,2,4-triazol-1-yl)ethanol Openeye Name: 1-phenyl-1-[2-sulfanyl-1-(trifluoromethyl)cyclopropyl]-2-(1,2,4-triazol-1-yl)ethanol CAS Name: 1-[2-mercapto-1-(trifluoromethyl)cyclopropyl]-1-phenyl-2-(1,2,4-triazol-1-yl)ethanol IUPAC Name: 1-phenyl-1-[2-sulfanyl-1-(trifluoromethyl)cyclopropyl]-2-(1,2,4-triazol-1-yl)ethanol Traditional Name: 1-[2-mercapto-1-(trifluoromethyl)cyclopropyl]-1-phenyl-2-(1,2,4-triazol-1-yl)ethanol Formula: C14H14F3N3OS MolecularWeight: 329.34067

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C1(C(CN2C=NC=N2)(C3=CC=CC=C3)O)C(F)(F)F)S

Isomeric SMILES

C1C(C1(C(CN2C=NC=N2)(C3=CC=CC=C3)O)C(F)(F)F)S

InChI

InChI=1S/C14H14F3N3OS/c15-14(16,17)12(6-11(12)22)13(21,7-20-9-18-8-19-20)10-4-2-1-3-5-10/h1-5,8-9,11,21-22H,6-7H2