1-(4-fluorophenyl)-5-methyl-N-[2-(phenylmethylsulfanyl)ethyl]-1,2,4-triazole-3-carboxamide

Systemtic Name: 1-(4-fluorophenyl)-5-methyl-N-[2-(phenylmethylsulfanyl)ethyl]-1,2,4-triazole-3-carboxamide Openeye Name: N-(2-benzylsulfanylethyl)-1-(4-fluorophenyl)-5-methyl-1,2,4-triazole-3-carboxamide CAS Name: 1-(4-fluorophenyl)-5-methyl-N-[2-(phenylmethylthio)ethyl]-1,2,4-triazole-3-carboxamide IUPAC Name: N-(2-benzylsulfanylethyl)-1-(4-fluorophenyl)-5-methyl-1,2,4-triazole-3-carboxamide Traditional Name: N-[2-(benzylthio)ethyl]-1-(4-fluorophenyl)-5-methyl-1,2,4-triazole-3-carboxamide Formula: C19H19FN4OS MolecularWeight: 370.443763

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NN1C2=CC=C(C=C2)F)C(=O)NCCSCC3=CC=CC=C3

Isomeric SMILES

CC1=NC(=NN1C2=CC=C(C=C2)F)C(=O)NCCSCC3=CC=CC=C3

InChI

InChI=1S/C19H19FN4OS/c1-14-22-18(23-24(14)17-9-7-16(20)8-10-17)19(25)21-11-12-26-13-15-5-3-2-4-6-15/h2-10H,11-13H2,1H3,(H,21,25)