N-[2-(4-chlorophenyl)-2-thiophen-2-ylsulfonyl-ethyl]-1,3-benzodioxole-5-sulfonamide

Systemtic Name: N-[2-(4-chlorophenyl)-2-thiophen-2-ylsulfonyl-ethyl]-1,3-benzodioxole-5-sulfonamide Openeye Name: N-[2-(4-chlorophenyl)-2-(2-thienylsulfonyl)ethyl]-1,3-benzodioxole-5-sulfonamide CAS Name: N-[2-(4-chlorophenyl)-2-thiophen-2-ylsulfonylethyl]-1,3-benzodioxole-5-sulfonamide IUPAC Name: N-[2-(4-chlorophenyl)-2-thiophen-2-ylsulfonylethyl]-1,3-benzodioxole-5-sulfonamide Traditional Name: N-[2-(4-chlorophenyl)-2-(2-thienylsulfonyl)ethyl]-1,3-benzodioxole-5-sulfonamide Formula: C19H16ClNO6S3 MolecularWeight: 485.98144

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)S(=O)(=O)NCC(C3=CC=C(C=C3)Cl)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)S(=O)(=O)NCC(C3=CC=C(C=C3)Cl)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C19H16ClNO6S3/c20-14-5-3-13(4-6-14)18(29(22,23)19-2-1-9-28-19)11-21-30(24,25)15-7-8-16-17(10-15)27-12-26-16/h1-10,18,21H,11-12H2