N-[(3S)-2-oxidanylidenethiolan-3-yl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide

Systemtic Name: N-[(3S)-2-oxidanylidenethiolan-3-yl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Openeye Name: N-[(3S)-2-oxotetrahydrothiophen-3-yl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide CAS Name: N-[(3S)-2-oxo-3-thiolanyl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide IUPAC Name: N-[(3S)-2-oxothiolan-3-yl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide Traditional Name: N-[(3S)-2-ketotetrahydrothiophen-3-yl]-2,3-dihydro-1,4-benzodioxin-6-sulfonamide Formula: C12H13NO5S2 MolecularWeight: 315.36532

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(=O)C1NS(=O)(=O)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

C1CSC(=O)[C@H]1NS(=O)(=O)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C12H13NO5S2/c14-12-9(3-6-19-12)13-20(15,16)8-1-2-10-11(7-8)18-5-4-17-10/h1-2,7,9,13H,3-6H2/t9-/m0/s1