[(2R)-4-oxidanidyl-3-oxidanylidene-1,4-benzothiazin-2-yl] carbamimidothioate

Systemtic Name: [(2R)-4-oxidanidyl-3-oxidanylidene-1,4-benzothiazin-2-yl] carbamimidothioate Openeye Name: 2-[(2R)-4-oxido-3-oxo-1,4-benzothiazin-2-yl]isothiourea CAS Name: carbamimidothioic acid [(2R)-4-oxido-3-oxo-1,4-benzothiazin-2-yl] ester IUPAC Name: [(2R)-4-oxido-3-oxo-1,4-benzothiazin-2-yl] carbamimidothioate Traditional Name: 2-[(2R)-3-keto-4-oxido-1,4-benzothiazin-2-yl]isothiourea Formula: C9H8N3O2S2- MolecularWeight: 254.30872

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C(=O)C(S2)SC(=N)N)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N(C(=O)[C@H](S2)SC(=N)N)[O-]

InChI

InChI=1S/C9H8N3O2S2/c10-9(11)16-8-7(13)12(14)5-3-1-2-4-6(5)15-8/h1-4,8H,(H3,10,11)/q-1/t8-/m1/s1