2-[1,1-bis(oxidanylidene)-2,3-dihydro-1,2-benzothiazol-3-yl]-2-methylsulfonyl-ethanenitrile

Systemtic Name: 2-[1,1-bis(oxidanylidene)-2,3-dihydro-1,2-benzothiazol-3-yl]-2-methylsulfonyl-ethanenitrile Openeye Name: 2-(1,1-dioxo-2,3-dihydro-1,2-benzothiazol-3-yl)-2-methylsulfonyl-acetonitrile CAS Name: 2-(1,1-dioxo-2,3-dihydro-1,2-benzothiazol-3-yl)-2-methylsulfonylacetonitrile IUPAC Name: 2-(1,1-dioxo-2,3-dihydro-1,2-benzothiazol-3-yl)-2-methylsulfonylacetonitrile Traditional Name: 2-(1,1-diketo-2,3-dihydro-1,2-benzothiazol-3-yl)-2-mesyl-acetonitrile Formula: C10H10N2O4S2 MolecularWeight: 286.3274

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C(C#N)C1C2=CC=CC=C2S(=O)(=O)N1

Isomeric SMILES

CS(=O)(=O)C(C#N)C1C2=CC=CC=C2S(=O)(=O)N1

InChI

InChI=1S/C10H10N2O4S2/c1-17(13,14)9(6-11)10-7-4-2-3-5-8(7)18(15,16)12-10/h2-5,9-10,12H,1H3