N-[2-(4-chlorophenyl)-2-thiophen-2-ylsulfonyl-ethyl]-3,4-dimethoxy-benzenesulfonamide

Systemtic Name: N-[2-(4-chlorophenyl)-2-thiophen-2-ylsulfonyl-ethyl]-3,4-dimethoxy-benzenesulfonamide Openeye Name: N-[2-(4-chlorophenyl)-2-(2-thienylsulfonyl)ethyl]-3,4-dimethoxy-benzenesulfonamide CAS Name: N-[2-(4-chlorophenyl)-2-thiophen-2-ylsulfonylethyl]-3,4-dimethoxybenzenesulfonamide IUPAC Name: N-[2-(4-chlorophenyl)-2-thiophen-2-ylsulfonylethyl]-3,4-dimethoxybenzenesulfonamide Traditional Name: N-[2-(4-chlorophenyl)-2-(2-thienylsulfonyl)ethyl]-3,4-dimethoxy-benzenesulfonamide Formula: C20H20ClNO6S3 MolecularWeight: 502.0239

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NCC(C2=CC=C(C=C2)Cl)S(=O)(=O)C3=CC=CS3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NCC(C2=CC=C(C=C2)Cl)S(=O)(=O)C3=CC=CS3)OC

InChI

InChI=1S/C20H20ClNO6S3/c1-27-17-10-9-16(12-18(17)28-2)31(25,26)22-13-19(14-5-7-15(21)8-6-14)30(23,24)20-4-3-11-29-20/h3-12,19,22H,13H2,1-2H3