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

Systemtic Name: 3-[(3,4-dimethoxyphenyl)methyl]-4-(2-methoxyethyl)-1H-1,2,4-triazole-5-thione Openeye Name: 3-[(3,4-dimethoxyphenyl)methyl]-4-(2-methoxyethyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-[(3,4-dimethoxyphenyl)methyl]-4-(2-methoxyethyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[(3,4-dimethoxyphenyl)methyl]-4-(2-methoxyethyl)-1H-1,2,4-triazole-5-thione Traditional Name: 4-(2-methoxyethyl)-3-veratryl-1H-1,2,4-triazole-5-thione Formula: C14H19N3O3S MolecularWeight: 309.38396

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=NNC1=S)CC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

COCCN1C(=NNC1=S)CC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C14H19N3O3S/c1-18-7-6-17-13(15-16-14(17)21)9-10-4-5-11(19-2)12(8-10)20-3/h4-5,8H,6-7,9H2,1-3H3,(H,16,21)