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

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

CC(C(=O)O)SCC(=O)N1CCSC2=CC=CC=C21

Isomeric SMILES

CC(C(=O)O)SCC(=O)N1CCSC2=CC=CC=C21

InChI

InChI=1S/C13H15NO3S2/c1-9(13(16)17)19-8-12(15)14-6-7-18-11-5-3-2-4-10(11)14/h2-5,9H,6-8H2,1H3,(H,16,17)