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

Systemtic Name: 2-[[(4,5-dimethoxy-2-methyl-phenyl)methyl-methyl-amino]methyl]-5-(4-methylphenyl)-1H-1,2,4-triazole-3-thione Openeye Name: 2-[[(4,5-dimethoxy-2-methyl-phenyl)methyl-methyl-amino]methyl]-5-(p-tolyl)-1H-1,2,4-triazole-3-thione CAS Name: 2-[[(4,5-dimethoxy-2-methylphenyl)methyl-methylamino]methyl]-5-(4-methylphenyl)-1H-1,2,4-triazole-3-thione IUPAC Name: 2-[[(4,5-dimethoxy-2-methylphenyl)methyl-methylamino]methyl]-5-(4-methylphenyl)-1H-1,2,4-triazole-3-thione Traditional Name: 2-[[(4,5-dimethoxy-2-methyl-benzyl)-methyl-amino]methyl]-5-(p-tolyl)-1H-1,2,4-triazole-3-thione Formula: C21H26N4O2S MolecularWeight: 398.52174

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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=C3C)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=S)N(N2)CN(C)CC3=CC(=C(C=C3C)OC)OC

InChI

InChI=1S/C21H26N4O2S/c1-14-6-8-16(9-7-14)20-22-21(28)25(23-20)13-24(3)12-17-11-19(27-5)18(26-4)10-15(17)2/h6-11H,12-13H2,1-5H3,(H,22,23,28)