4-azanyl-3-(3,4-dimethoxyphenyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-azanyl-3-(3,4-dimethoxyphenyl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-amino-3-(3,4-dimethoxyphenyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-amino-3-(3,4-dimethoxyphenyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-amino-3-(3,4-dimethoxyphenyl)-1H-1,2,4-triazole-5-thione Traditional Name: 4-amino-3-(3,4-dimethoxyphenyl)-1H-1,2,4-triazole-5-thione Formula: C10H12N4O2S MolecularWeight: 252.29288

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NNC(=S)N2N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NNC(=S)N2N)OC

InChI

InChI=1S/C10H12N4O2S/c1-15-7-4-3-6(5-8(7)16-2)9-12-13-10(17)14(9)11/h3-5H,11H2,1-2H3,(H,13,17)