6-(3-methoxy-4-oxidanyl-phenyl)-1,2,4,5-tetrazinane-3-thione

Systemtic Name: 6-(3-methoxy-4-oxidanyl-phenyl)-1,2,4,5-tetrazinane-3-thione Openeye Name: 6-(4-hydroxy-3-methoxy-phenyl)-1,2,4,5-tetrazinane-3-thione CAS Name: 6-(4-hydroxy-3-methoxyphenyl)-1,2,4,5-tetrazinane-3-thione IUPAC Name: 6-(4-hydroxy-3-methoxyphenyl)-1,2,4,5-tetrazinane-3-thione Traditional Name: 6-(4-hydroxy-3-methoxy-phenyl)-1,2,4,5-tetrazinane-3-thione Formula: C9H12N4O2S MolecularWeight: 240.28218

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2NNC(=S)NN2)O

Isomeric SMILES

COC1=C(C=CC(=C1)C2NNC(=S)NN2)O

InChI

InChI=1S/C9H12N4O2S/c1-15-7-4-5(2-3-6(7)14)8-10-12-9(16)13-11-8/h2-4,8,10-11,14H,1H3,(H2,12,13,16)