N-[2-(1,3-benzodioxol-5-yl)-2-thiophen-2-ylsulfonyl-ethyl]-4-oxidanyl-1,1-bis(oxidanylidene)thiolane-3-sulfonamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)-2-thiophen-2-ylsulfonyl-ethyl]-4-oxidanyl-1,1-bis(oxidanylidene)thiolane-3-sulfonamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)-2-(2-thienylsulfonyl)ethyl]-4-hydroxy-1,1-dioxo-thiolane-3-sulfonamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)-2-thiophen-2-ylsulfonylethyl]-4-hydroxy-1,1-dioxo-3-thiolanesulfonamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)-2-thiophen-2-ylsulfonylethyl]-4-hydroxy-1,1-dioxothiolane-3-sulfonamide Traditional Name: N-[2-(1,3-benzodioxol-5-yl)-2-(2-thienylsulfonyl)ethyl]-4-hydroxy-1,1-diketo-thiolane-3-sulfonamide Formula: C17H19NO9S4 MolecularWeight: 509.59406

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(CS1(=O)=O)S(=O)(=O)NCC(C2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC=CS4)O

Isomeric SMILES

C1C(C(CS1(=O)=O)S(=O)(=O)NCC(C2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC=CS4)O

InChI

InChI=1S/C17H19NO9S4/c19-12-8-29(20,21)9-16(12)31(24,25)18-7-15(30(22,23)17-2-1-5-28-17)11-3-4-13-14(6-11)27-10-26-13/h1-6,12,15-16,18-19H,7-10H2