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

Systemtic Name: 2-[[(4,5-dimethoxy-2-methyl-phenyl)methyl-methyl-amino]methyl]-5-(4-ethylphenyl)-1H-1,2,4-triazole-3-thione Openeye Name: 2-[[(4,5-dimethoxy-2-methyl-phenyl)methyl-methyl-amino]methyl]-5-(4-ethylphenyl)-1H-1,2,4-triazole-3-thione CAS Name: 2-[[(4,5-dimethoxy-2-methylphenyl)methyl-methylamino]methyl]-5-(4-ethylphenyl)-1H-1,2,4-triazole-3-thione IUPAC Name: 2-[[(4,5-dimethoxy-2-methylphenyl)methyl-methylamino]methyl]-5-(4-ethylphenyl)-1H-1,2,4-triazole-3-thione Traditional Name: 2-[[(4,5-dimethoxy-2-methyl-benzyl)-methyl-amino]methyl]-5-(4-ethylphenyl)-1H-1,2,4-triazole-3-thione Formula: C22H28N4O2S MolecularWeight: 412.54832

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC(=S)N(N2)CN(C)CC3=CC(=C(C=C3C)OC)OC

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC(=S)N(N2)CN(C)CC3=CC(=C(C=C3C)OC)OC

InChI

InChI=1S/C22H28N4O2S/c1-6-16-7-9-17(10-8-16)21-23-22(29)26(24-21)14-25(3)13-18-12-20(28-5)19(27-4)11-15(18)2/h7-12H,6,13-14H2,1-5H3,(H,23,24,29)