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

Systemtic Name: 3-[(2,3-dimethoxyphenyl)methyl]-4-phenyl-1H-1,2,4-triazole-5-thione Openeye Name: 3-[(2,3-dimethoxyphenyl)methyl]-4-phenyl-1H-1,2,4-triazole-5-thione CAS Name: 3-[(2,3-dimethoxyphenyl)methyl]-4-phenyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[(2,3-dimethoxyphenyl)methyl]-4-phenyl-1H-1,2,4-triazole-5-thione Traditional Name: 3-o-veratryl-4-phenyl-1H-1,2,4-triazole-5-thione Formula: C17H17N3O2S MolecularWeight: 327.40078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)CC2=NNC(=S)N2C3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC(=C1OC)CC2=NNC(=S)N2C3=CC=CC=C3

InChI

InChI=1S/C17H17N3O2S/c1-21-14-10-6-7-12(16(14)22-2)11-15-18-19-17(23)20(15)13-8-4-3-5-9-13/h3-10H,11H2,1-2H3,(H,19,23)