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

Systemtic Name: 2-[[(3,4-dimethoxyphenyl)methyl-methyl-amino]methyl]-5-(4-methylphenyl)-1H-1,2,4-triazole-3-thione Openeye Name: 2-[[(3,4-dimethoxyphenyl)methyl-methyl-amino]methyl]-5-(p-tolyl)-1H-1,2,4-triazole-3-thione CAS Name: 2-[[(3,4-dimethoxyphenyl)methyl-methylamino]methyl]-5-(4-methylphenyl)-1H-1,2,4-triazole-3-thione IUPAC Name: 2-[[(3,4-dimethoxyphenyl)methyl-methylamino]methyl]-5-(4-methylphenyl)-1H-1,2,4-triazole-3-thione Traditional Name: 2-[[methyl(veratryl)amino]methyl]-5-(p-tolyl)-1H-1,2,4-triazole-3-thione Formula: C20H24N4O2S MolecularWeight: 384.49516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=S)N(N2)CN(C)CC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=S)N(N2)CN(C)CC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C20H24N4O2S/c1-14-5-8-16(9-6-14)19-21-20(27)24(22-19)13-23(2)12-15-7-10-17(25-3)18(11-15)26-4/h5-11H,12-13H2,1-4H3,(H,21,22,27)