2-methylsulfonyl-N-[3-(2-phenylethynyl)-2H-indazol-5-yl]benzenesulfonamide

Systemtic Name: 2-methylsulfonyl-N-[3-(2-phenylethynyl)-2H-indazol-5-yl]benzenesulfonamide Openeye Name: 2-methylsulfonyl-N-[3-(2-phenylethynyl)-2H-indazol-5-yl]benzenesulfonamide CAS Name: 2-methylsulfonyl-N-[3-(2-phenylethynyl)-2H-indazol-5-yl]benzenesulfonamide IUPAC Name: 2-methylsulfonyl-N-[3-(2-phenylethynyl)-2H-indazol-5-yl]benzenesulfonamide Traditional Name: 2-mesyl-N-[3-(2-phenylethynyl)-2H-indazol-5-yl]benzenesulfonamide Formula: C22H17N3O4S2 MolecularWeight: 451.51808

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1S(=O)(=O)NC2=CC3=C(NN=C3C=C2)C#CC4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1S(=O)(=O)NC2=CC3=C(NN=C3C=C2)C#CC4=CC=CC=C4

InChI

InChI=1S/C22H17N3O4S2/c1-30(26,27)21-9-5-6-10-22(21)31(28,29)25-17-12-14-20-18(15-17)19(23-24-20)13-11-16-7-3-2-4-8-16/h2-10,12,14-15,25H,1H3,(H,23,24)