2-[5-(3,4-dihydro-2H-thiochromen-6-yl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide

Systemtic Name: 2-[5-(3,4-dihydro-2H-thiochromen-6-yl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide Openeye Name: 2-[5-thiochroman-6-yl-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide CAS Name: 2-[5-(3,4-dihydro-2H-1-benzothiopyran-6-yl)-3-(trifluoromethyl)-1-pyrazolyl]benzenesulfonamide IUPAC Name: 2-[5-(3,4-dihydro-2H-thiochromen-6-yl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide Traditional Name: 2-[5-thiochroman-6-yl-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide Formula: C19H16F3N3O2S2 MolecularWeight: 439.47445

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2)C3=CC(=NN3C4=CC=CC=C4S(=O)(=O)N)C(F)(F)F)SC1

Isomeric SMILES

C1CC2=C(C=CC(=C2)C3=CC(=NN3C4=CC=CC=C4S(=O)(=O)N)C(F)(F)F)SC1

InChI

InChI=1S/C19H16F3N3O2S2/c20-19(21,22)18-11-15(12-7-8-16-13(10-12)4-3-9-28-16)25(24-18)14-5-1-2-6-17(14)29(23,26)27/h1-2,5-8,10-11H,3-4,9H2,(H2,23,26,27)