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

Systemtic Name: 2-[[5-(2-cyclopentylethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-[4-(trifluoromethyloxy)phenyl]propanamide Openeye Name: 2-[[5-(2-cyclopentylethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-[4-(trifluoromethoxy)phenyl]propanamide CAS Name: 2-[[5-(2-cyclopentylethyl)-1H-1,2,4-triazol-3-yl]thio]-N-[4-(trifluoromethoxy)phenyl]propanamide IUPAC Name: 2-[[5-(2-cyclopentylethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-[4-(trifluoromethoxy)phenyl]propanamide Traditional Name: 2-[[5-(2-cyclopentylethyl)-1H-1,2,4-triazol-3-yl]thio]-N-[4-(trifluoromethoxy)phenyl]propionamide Formula: C19H23F3N4O2S MolecularWeight: 428.47173

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)OC(F)(F)F)SC2=NNC(=N2)CCC3CCCC3

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)OC(F)(F)F)SC2=NNC(=N2)CCC3CCCC3

InChI

InChI=1S/C19H23F3N4O2S/c1-12(17(27)23-14-7-9-15(10-8-14)28-19(20,21)22)29-18-24-16(25-26-18)11-6-13-4-2-3-5-13/h7-10,12-13H,2-6,11H2,1H3,(H,23,27)(H,24,25,26)