2-methylsulfanylethyl 2-[(2S)-3-oxidanylidene-4H-1,4-benzothiazin-2-yl]ethanoate

Systemtic Name: 2-methylsulfanylethyl 2-[(2S)-3-oxidanylidene-4H-1,4-benzothiazin-2-yl]ethanoate Openeye Name: 2-methylsulfanylethyl 2-[(2S)-3-oxo-4H-1,4-benzothiazin-2-yl]acetate CAS Name: 2-[(2S)-3-oxo-4H-1,4-benzothiazin-2-yl]acetic acid 2-(methylthio)ethyl ester IUPAC Name: 2-methylsulfanylethyl 2-[(2S)-3-oxo-4H-1,4-benzothiazin-2-yl]acetate Traditional Name: 2-[(2S)-3-keto-4H-1,4-benzothiazin-2-yl]acetic acid 2-(methylthio)ethyl ester Formula: C13H15NO3S2 MolecularWeight: 297.3931

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Descriptors Computed from Structure

Canonical SMILES:

CSCCOC(=O)CC1C(=O)NC2=CC=CC=C2S1

Isomeric SMILES

CSCCOC(=O)C[C@H]1C(=O)NC2=CC=CC=C2S1

InChI

InChI=1S/C13H15NO3S2/c1-18-7-6-17-12(15)8-11-13(16)14-9-4-2-3-5-10(9)19-11/h2-5,11H,6-8H2,1H3,(H,14,16)/t11-/m0/s1