methyl 2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]sulfanyl]ethanoate

Systemtic Name: methyl 2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]sulfanyl]ethanoate Openeye Name: methyl 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)sulfanyl]acetate CAS Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)thio]acetic acid methyl ester IUPAC Name: methyl 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)sulfanyl]acetate Traditional Name: 2-[(1,1-diketo-1,2-benzothiazol-3-yl)thio]acetic acid methyl ester Formula: C10H9NO4S2 MolecularWeight: 271.31276

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSC1=NS(=O)(=O)C2=CC=CC=C21

Isomeric SMILES

COC(=O)CSC1=NS(=O)(=O)C2=CC=CC=C21

InChI

InChI=1S/C10H9NO4S2/c1-15-9(12)6-16-10-7-4-2-3-5-8(7)17(13,14)11-10/h2-5H,6H2,1H3