2-(3-sulfanylidene-1,4-benzothiazin-4-yl)ethanoic acid

Systemtic Name: 2-(3-sulfanylidene-1,4-benzothiazin-4-yl)ethanoic acid Openeye Name: 2-(3-thioxo-1,4-benzothiazin-4-yl)acetic acid CAS Name: 2-(3-sulfanylidene-1,4-benzothiazin-4-yl)acetic acid IUPAC Name: 2-(3-sulfanylidene-1,4-benzothiazin-4-yl)acetic acid Traditional Name: 2-(3-thioxo-1,4-benzothiazin-4-yl)acetic acid Formula: C10H9NO2S2 MolecularWeight: 239.31396

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=S)N(C2=CC=CC=C2S1)CC(=O)O

Isomeric SMILES

C1C(=S)N(C2=CC=CC=C2S1)CC(=O)O

InChI

InChI=1S/C10H9NO2S2/c12-10(13)5-11-7-3-1-2-4-8(7)15-6-9(11)14/h1-4H,5-6H2,(H,12,13)