4-[(2,3,4-trimethoxyphenyl)methylamino]-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-[(2,3,4-trimethoxyphenyl)methylamino]-1H-1,2,4-triazole-5-thione Openeye Name: 4-[(2,3,4-trimethoxyphenyl)methylamino]-1H-1,2,4-triazole-5-thione CAS Name: 4-[(2,3,4-trimethoxyphenyl)methylamino]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[(2,3,4-trimethoxyphenyl)methylamino]-1H-1,2,4-triazole-5-thione Traditional Name: 4-[(2,3,4-trimethoxybenzyl)amino]-1H-1,2,4-triazole-5-thione Formula: C12H16N4O3S MolecularWeight: 296.34544

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)CNN2C=NNC2=S)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)CNN2C=NNC2=S)OC)OC

InChI

InChI=1S/C12H16N4O3S/c1-17-9-5-4-8(10(18-2)11(9)19-3)6-14-16-7-13-15-12(16)20/h4-5,7,14H,6H2,1-3H3,(H,15,20)