3-(3,4,5-trimethoxyphenyl)-3H-1,2,4,5-tetrazine-2,4-diium-6-thione

Systemtic Name: 3-(3,4,5-trimethoxyphenyl)-3H-1,2,4,5-tetrazine-2,4-diium-6-thione Openeye Name: 3-(3,4,5-trimethoxyphenyl)-3H-1,2,4,5-tetrazine-2,4-diium-6-thione CAS Name: 3-(3,4,5-trimethoxyphenyl)-3H-1,2,4,5-tetrazine-2,4-diium-6-thione IUPAC Name: 3-(3,4,5-trimethoxyphenyl)-3H-1,2,4,5-tetrazine-2,4-diium-6-thione Traditional Name: 3-(3,4,5-trimethoxyphenyl)-3H-1,2,4,5-tetrazine-2,4-diium-6-thione Formula: C11H14N4O3S+2 MolecularWeight: 282.31886

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2[NH+]=NC(=S)N=[NH+]2

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2[NH+]=NC(=S)N=[NH+]2

InChI

InChI=1S/C11H12N4O3S/c1-16-7-4-6(5-8(17-2)9(7)18-3)10-12-14-11(19)15-13-10/h4-5,10H,1-3H3/p+2