3-(4-fluorophenyl)-N-(3-methylsulfanyl-1H-1,2,4-triazol-5-yl)propanamide

Systemtic Name: 3-(4-fluorophenyl)-N-(3-methylsulfanyl-1H-1,2,4-triazol-5-yl)propanamide Openeye Name: 3-(4-fluorophenyl)-N-(3-methylsulfanyl-1H-1,2,4-triazol-5-yl)propanamide CAS Name: 3-(4-fluorophenyl)-N-[3-(methylthio)-1H-1,2,4-triazol-5-yl]propanamide IUPAC Name: 3-(4-fluorophenyl)-N-(3-methylsulfanyl-1H-1,2,4-triazol-5-yl)propanamide Traditional Name: 3-(4-fluorophenyl)-N-[3-(methylthio)-1H-1,2,4-triazol-5-yl]propionamide Formula: C12H13FN4OS MolecularWeight: 280.321223

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=NNC(=N1)NC(=O)CCC2=CC=C(C=C2)F

Isomeric SMILES

CSC1=NNC(=N1)NC(=O)CCC2=CC=C(C=C2)F

InChI

InChI=1S/C12H13FN4OS/c1-19-12-15-11(16-17-12)14-10(18)7-4-8-2-5-9(13)6-3-8/h2-3,5-6H,4,7H2,1H3,(H2,14,15,16,17,18)