4-methylsulfonyl-N-[3-(2-thiophen-2-ylethynyl)phenyl]benzenesulfonamide

Systemtic Name: 4-methylsulfonyl-N-[3-(2-thiophen-2-ylethynyl)phenyl]benzenesulfonamide Openeye Name: 4-methylsulfonyl-N-[3-[2-(2-thienyl)ethynyl]phenyl]benzenesulfonamide CAS Name: 4-methylsulfonyl-N-[3-(2-thiophen-2-ylethynyl)phenyl]benzenesulfonamide IUPAC Name: 4-methylsulfonyl-N-[3-(2-thiophen-2-ylethynyl)phenyl]benzenesulfonamide Traditional Name: 4-mesyl-N-[3-[2-(2-thienyl)ethynyl]phenyl]benzenesulfonamide Formula: C19H15NO4S3 MolecularWeight: 417.5217

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)C#CC3=CC=CS3

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)C#CC3=CC=CS3

InChI

InChI=1S/C19H15NO4S3/c1-26(21,22)18-9-11-19(12-10-18)27(23,24)20-16-5-2-4-15(14-16)7-8-17-6-3-13-25-17/h2-6,9-14,20H,1H3