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

Systemtic Name: 4-(2,5-dimethylphenyl)-3-[[(3-methylphenyl)amino]methyl]-1H-1,2,4-triazole-5-thione Openeye Name: 4-(2,5-dimethylphenyl)-3-[(3-methylanilino)methyl]-1H-1,2,4-triazole-5-thione CAS Name: 4-(2,5-dimethylphenyl)-3-[(3-methylanilino)methyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(2,5-dimethylphenyl)-3-[(3-methylanilino)methyl]-1H-1,2,4-triazole-5-thione Traditional Name: 4-(2,5-dimethylphenyl)-3-(m-toluidinomethyl)-1H-1,2,4-triazole-5-thione Formula: C18H20N4S MolecularWeight: 324.4432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NCC2=NNC(=S)N2C3=C(C=CC(=C3)C)C

Isomeric SMILES

CC1=CC(=CC=C1)NCC2=NNC(=S)N2C3=C(C=CC(=C3)C)C

InChI

InChI=1S/C18H20N4S/c1-12-5-4-6-15(9-12)19-11-17-20-21-18(23)22(17)16-10-13(2)7-8-14(16)3/h4-10,19H,11H2,1-3H3,(H,21,23)