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

Systemtic Name: 3-[[(2,6-dimethylphenyl)amino]methyl]-4-methyl-1H-1,2,4-triazole-5-thione Openeye Name: 3-[(2,6-dimethylanilino)methyl]-4-methyl-1H-1,2,4-triazole-5-thione CAS Name: 3-[(2,6-dimethylanilino)methyl]-4-methyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[(2,6-dimethylanilino)methyl]-4-methyl-1H-1,2,4-triazole-5-thione Traditional Name: 3-[(2,6-dimethylanilino)methyl]-4-methyl-1H-1,2,4-triazole-5-thione Formula: C12H16N4S MolecularWeight: 248.34724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NCC2=NNC(=S)N2C

Isomeric SMILES

CC1=C(C(=CC=C1)C)NCC2=NNC(=S)N2C

InChI

InChI=1S/C12H16N4S/c1-8-5-4-6-9(2)11(8)13-7-10-14-15-12(17)16(10)3/h4-6,13H,7H2,1-3H3,(H,15,17)