3-methoxy-5-(5-sulfanylidene-1,2,3,4-tetrazolidin-1-yl)cyclohexa-3,5-diene-1,2-dione

Systemtic Name: 3-methoxy-5-(5-sulfanylidene-1,2,3,4-tetrazolidin-1-yl)cyclohexa-3,5-diene-1,2-dione Openeye Name: 3-methoxy-5-(5-thioxotetrazolidin-1-yl)-1,2-benzoquinone CAS Name: 3-methoxy-5-(5-sulfanylidene-1-tetrazolidinyl)cyclohexa-3,5-diene-1,2-dione IUPAC Name: 3-methoxy-5-(5-sulfanylidenetetrazolidin-1-yl)cyclohexa-3,5-diene-1,2-dione Traditional Name: 3-methoxy-5-(5-thioxotetrazolidin-1-yl)-o-benzoquinone Formula: C8H8N4O3S MolecularWeight: 240.23912

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=O)C1=O)N2C(=S)NNN2

Isomeric SMILES

COC1=CC(=CC(=O)C1=O)N2C(=S)NNN2

InChI

InChI=1S/C8H8N4O3S/c1-15-6-3-4(2-5(13)7(6)14)12-8(16)9-10-11-12/h2-3,10-11H,1H3,(H,9,16)