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

Systemtic Name: 3-[[(2-methoxyphenyl)amino]methyl]-4-phenyl-1H-1,2,4-triazole-5-thione Openeye Name: 3-[(2-methoxyanilino)methyl]-4-phenyl-1H-1,2,4-triazole-5-thione CAS Name: 3-[(2-methoxyanilino)methyl]-4-phenyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[(2-methoxyanilino)methyl]-4-phenyl-1H-1,2,4-triazole-5-thione Traditional Name: 3-(o-anisidinomethyl)-4-phenyl-1H-1,2,4-triazole-5-thione Formula: C16H16N4OS MolecularWeight: 312.38944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NCC2=NNC(=S)N2C3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC=C1NCC2=NNC(=S)N2C3=CC=CC=C3

InChI

InChI=1S/C16H16N4OS/c1-21-14-10-6-5-9-13(14)17-11-15-18-19-16(22)20(15)12-7-3-2-4-8-12/h2-10,17H,11H2,1H3,(H,19,22)