2,3-bis(oxidanylidene)-7-sulfanyl-1,4-oxazepane-5-carbothioic S-acid

Systemtic Name: 2,3-bis(oxidanylidene)-7-sulfanyl-1,4-oxazepane-5-carbothioic S-acid Openeye Name: 2,3-dioxo-7-sulfanyl-1,4-oxazepane-5-carbothioic S-acid CAS Name: 7-mercapto-2,3-dioxo-1,4-oxazepane-5-carbothioic S-acid IUPAC Name: 2,3-dioxo-7-sulfanyl-1,4-oxazepane-5-carbothioic S-acid Traditional Name: 2,3-diketo-7-mercapto-1,4-oxazepane-5-carbothioic S-acid Formula: C6H7NO4S2 MolecularWeight: 221.25408

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NC(=O)C(=O)OC1S)C(=O)S

Isomeric SMILES

C1C(NC(=O)C(=O)OC1S)C(=O)S

InChI

InChI=1S/C6H7NO4S2/c8-4-5(9)11-3(12)1-2(7-4)6(10)13/h2-3,12H,1H2,(H,7,8)(H,10,13)