2-bromanyl-4,5-dimethoxy-N-[3-(2-thiophen-2-ylethynyl)phenyl]benzenesulfonamide

Systemtic Name: 2-bromanyl-4,5-dimethoxy-N-[3-(2-thiophen-2-ylethynyl)phenyl]benzenesulfonamide Openeye Name: 2-bromo-4,5-dimethoxy-N-[3-[2-(2-thienyl)ethynyl]phenyl]benzenesulfonamide CAS Name: 2-bromo-4,5-dimethoxy-N-[3-(2-thiophen-2-ylethynyl)phenyl]benzenesulfonamide IUPAC Name: 2-bromo-4,5-dimethoxy-N-[3-(2-thiophen-2-ylethynyl)phenyl]benzenesulfonamide Traditional Name: 2-bromo-4,5-dimethoxy-N-[3-[2-(2-thienyl)ethynyl]phenyl]benzenesulfonamide Formula: C20H16BrNO4S2 MolecularWeight: 478.37934

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1OC)Br)S(=O)(=O)NC2=CC=CC(=C2)C#CC3=CC=CS3

Isomeric SMILES

COC1=CC(=C(C=C1OC)Br)S(=O)(=O)NC2=CC=CC(=C2)C#CC3=CC=CS3

InChI

InChI=1S/C20H16BrNO4S2/c1-25-18-12-17(21)20(13-19(18)26-2)28(23,24)22-15-6-3-5-14(11-15)8-9-16-7-4-10-27-16/h3-7,10-13,22H,1-2H3