2-[[4-azanyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-cyclohexyl-propanamide

Systemtic Name: 2-[[4-azanyl-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-cyclohexyl-propanamide Openeye Name: 2-[[4-amino-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-cyclohexyl-propanamide CAS Name: 2-[[4-amino-5-(trifluoromethyl)-1,2,4-triazol-3-yl]thio]-N-cyclohexylpropanamide IUPAC Name: 2-[[4-amino-5-(trifluoromethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-cyclohexylpropanamide Traditional Name: 2-[[4-amino-5-(trifluoromethyl)-1,2,4-triazol-3-yl]thio]-N-cyclohexyl-propionamide Formula: C12H18F3N5OS MolecularWeight: 337.36443

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCCC1)SC2=NN=C(N2N)C(F)(F)F

Isomeric SMILES

CC(C(=O)NC1CCCCC1)SC2=NN=C(N2N)C(F)(F)F

InChI

InChI=1S/C12H18F3N5OS/c1-7(9(21)17-8-5-3-2-4-6-8)22-11-19-18-10(20(11)16)12(13,14)15/h7-8H,2-6,16H2,1H3,(H,17,21)