3-[2-(2,3-dihydro-1,4-benzothiazin-4-yl)-2-oxidanylidene-ethyl]sulfanylpropanoic acid

Systemtic Name: 3-[2-(2,3-dihydro-1,4-benzothiazin-4-yl)-2-oxidanylidene-ethyl]sulfanylpropanoic acid Openeye Name: 3-[2-(2,3-dihydro-1,4-benzothiazin-4-yl)-2-oxo-ethyl]sulfanylpropanoic acid CAS Name: 3-[[2-(2,3-dihydro-1,4-benzothiazin-4-yl)-2-oxoethyl]thio]propanoic acid IUPAC Name: 3-[2-(2,3-dihydro-1,4-benzothiazin-4-yl)-2-oxoethyl]sulfanylpropanoic acid Traditional Name: 3-[[2-(2,3-dihydro-1,4-benzothiazin-4-yl)-2-keto-ethyl]thio]propionic acid Formula: C13H15NO3S2 MolecularWeight: 297.3931

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=CC=CC=C2N1C(=O)CSCCC(=O)O

Isomeric SMILES

C1CSC2=CC=CC=C2N1C(=O)CSCCC(=O)O

InChI

InChI=1S/C13H15NO3S2/c15-12(9-18-7-5-13(16)17)14-6-8-19-11-4-2-1-3-10(11)14/h1-4H,5-9H2,(H,16,17)