2-[2-(4-methylsulfonylphenyl)-2-oxidanylidene-ethyl]-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one

Systemtic Name: 2-[2-(4-methylsulfonylphenyl)-2-oxidanylidene-ethyl]-1,1-bis(oxidanylidene)-1,2-benzothiazol-3-one Openeye Name: 2-[2-(4-methylsulfonylphenyl)-2-oxo-ethyl]-1,1-dioxo-1,2-benzothiazol-3-one CAS Name: 2-[2-(4-methylsulfonylphenyl)-2-oxoethyl]-1,1-dioxo-1,2-benzothiazol-3-one IUPAC Name: 2-[2-(4-methylsulfonylphenyl)-2-oxoethyl]-1,1-dioxo-1,2-benzothiazol-3-one Traditional Name: 1,1-diketo-2-[2-keto-2-(4-mesylphenyl)ethyl]-1,2-benzothiazol-3-one Formula: C16H13NO6S2 MolecularWeight: 379.40752

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C(=O)CN2C(=O)C3=CC=CC=C3S2(=O)=O

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C(=O)CN2C(=O)C3=CC=CC=C3S2(=O)=O

InChI

InChI=1S/C16H13NO6S2/c1-24(20,21)12-8-6-11(7-9-12)14(18)10-17-16(19)13-4-2-3-5-15(13)25(17,22)23/h2-9H,10H2,1H3