2-[6-(4-nitrophenyl)-4-oxidanylidene-2-sulfanylidene-1,3-thiazin-3-yl]ethanoic acid

Systemtic Name: 2-[6-(4-nitrophenyl)-4-oxidanylidene-2-sulfanylidene-1,3-thiazin-3-yl]ethanoic acid Openeye Name: 2-[6-(4-nitrophenyl)-4-oxo-2-thioxo-1,3-thiazin-3-yl]acetic acid CAS Name: 2-[6-(4-nitrophenyl)-4-oxo-2-sulfanylidene-1,3-thiazin-3-yl]acetic acid IUPAC Name: 2-[6-(4-nitrophenyl)-4-oxo-2-sulfanylidene-1,3-thiazin-3-yl]acetic acid Traditional Name: 2-[4-keto-6-(4-nitrophenyl)-2-thioxo-1,3-thiazin-3-yl]acetic acid Formula: C12H8N2O5S2 MolecularWeight: 324.33232

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC(=O)N(C(=S)S2)CC(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=CC(=O)N(C(=S)S2)CC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C12H8N2O5S2/c15-10-5-9(21-12(20)13(10)6-11(16)17)7-1-3-8(4-2-7)14(18)19/h1-5H,6H2,(H,16,17)