3-[[(2,6-dimethylphenyl)amino]methyl]-4-(2-methoxyphenyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[[(2,6-dimethylphenyl)amino]methyl]-4-(2-methoxyphenyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-[(2,6-dimethylanilino)methyl]-4-(2-methoxyphenyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-[(2,6-dimethylanilino)methyl]-4-(2-methoxyphenyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[(2,6-dimethylanilino)methyl]-4-(2-methoxyphenyl)-1H-1,2,4-triazole-5-thione Traditional Name: 3-[(2,6-dimethylanilino)methyl]-4-(2-methoxyphenyl)-1H-1,2,4-triazole-5-thione Formula: C18H20N4OS MolecularWeight: 340.4426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NCC2=NNC(=S)N2C3=CC=CC=C3OC

Isomeric SMILES

CC1=C(C(=CC=C1)C)NCC2=NNC(=S)N2C3=CC=CC=C3OC

InChI

InChI=1S/C18H20N4OS/c1-12-7-6-8-13(2)17(12)19-11-16-20-21-18(24)22(16)14-9-4-5-10-15(14)23-3/h4-10,19H,11H2,1-3H3,(H,21,24)