N-[2-(1,3-benzodioxol-5-yl)-2-thiophen-2-ylsulfonyl-ethyl]-1,3-benzodioxole-5-sulfonamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)-2-thiophen-2-ylsulfonyl-ethyl]-1,3-benzodioxole-5-sulfonamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)-2-(2-thienylsulfonyl)ethyl]-1,3-benzodioxole-5-sulfonamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)-2-thiophen-2-ylsulfonylethyl]-1,3-benzodioxole-5-sulfonamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)-2-thiophen-2-ylsulfonylethyl]-1,3-benzodioxole-5-sulfonamide Traditional Name: N-[2-(1,3-benzodioxol-5-yl)-2-(2-thienylsulfonyl)ethyl]-1,3-benzodioxole-5-sulfonamide Formula: C20H17NO8S3 MolecularWeight: 495.54588

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(CNS(=O)(=O)C3=CC4=C(C=C3)OCO4)S(=O)(=O)C5=CC=CS5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(CNS(=O)(=O)C3=CC4=C(C=C3)OCO4)S(=O)(=O)C5=CC=CS5

InChI

InChI=1S/C20H17NO8S3/c22-31(23,20-2-1-7-30-20)19(13-3-5-15-17(8-13)28-11-26-15)10-21-32(24,25)14-4-6-16-18(9-14)29-12-27-16/h1-9,19,21H,10-12H2