3-[[(4-fluorophenyl)amino]methyl]-4-(2-methoxyphenyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[[(4-fluorophenyl)amino]methyl]-4-(2-methoxyphenyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-[(4-fluoroanilino)methyl]-4-(2-methoxyphenyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-[(4-fluoroanilino)methyl]-4-(2-methoxyphenyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[(4-fluoroanilino)methyl]-4-(2-methoxyphenyl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-[(4-fluoroanilino)methyl]-4-(2-methoxyphenyl)-1H-1,2,4-triazole-5-thione Formula: C16H15FN4OS MolecularWeight: 330.379903

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C(=NNC2=S)CNC3=CC=C(C=C3)F

Isomeric SMILES

COC1=CC=CC=C1N2C(=NNC2=S)CNC3=CC=C(C=C3)F

InChI

InChI=1S/C16H15FN4OS/c1-22-14-5-3-2-4-13(14)21-15(19-20-16(21)23)10-18-12-8-6-11(17)7-9-12/h2-9,18H,10H2,1H3,(H,20,23)