4-(2,5-dimethylphenyl)-2-[[(4-ethoxy-3-methoxy-phenyl)methyl-methyl-amino]methyl]-1,2,4-triazole-3-thione

Systemtic Name: 4-(2,5-dimethylphenyl)-2-[[(4-ethoxy-3-methoxy-phenyl)methyl-methyl-amino]methyl]-1,2,4-triazole-3-thione Openeye Name: 4-(2,5-dimethylphenyl)-2-[[(4-ethoxy-3-methoxy-phenyl)methyl-methyl-amino]methyl]-1,2,4-triazole-3-thione CAS Name: 4-(2,5-dimethylphenyl)-2-[[(4-ethoxy-3-methoxyphenyl)methyl-methylamino]methyl]-1,2,4-triazole-3-thione IUPAC Name: 4-(2,5-dimethylphenyl)-2-[[(4-ethoxy-3-methoxyphenyl)methyl-methylamino]methyl]-1,2,4-triazole-3-thione Traditional Name: 4-(2,5-dimethylphenyl)-2-[[(4-ethoxy-3-methoxy-benzyl)-methyl-amino]methyl]-1,2,4-triazole-3-thione Formula: C22H28N4O2S MolecularWeight: 412.54832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CN(C)CN2C(=S)N(C=N2)C3=C(C=CC(=C3)C)C)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CN(C)CN2C(=S)N(C=N2)C3=C(C=CC(=C3)C)C)OC

InChI

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