N-(5-chloranyl-6-isoquinolin-3-yloxy-pyridin-3-yl)-4-(trifluoromethyloxy)benzenesulfonamide

Systemtic Name: N-(5-chloranyl-6-isoquinolin-3-yloxy-pyridin-3-yl)-4-(trifluoromethyloxy)benzenesulfonamide Openeye Name: N-[5-chloro-6-(3-isoquinolyloxy)-3-pyridyl]-4-(trifluoromethoxy)benzenesulfonamide CAS Name: N-[5-chloro-6-(3-isoquinolinyloxy)-3-pyridinyl]-4-(trifluoromethoxy)benzenesulfonamide IUPAC Name: N-(5-chloro-6-isoquinolin-3-yloxypyridin-3-yl)-4-(trifluoromethoxy)benzenesulfonamide Traditional Name: N-[5-chloro-6-(3-isoquinolyloxy)-3-pyridyl]-4-(trifluoromethoxy)benzenesulfonamide Formula: C21H13ClF3N3O4S MolecularWeight: 495.85883

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=NC(=CC2=C1)OC3=C(C=C(C=N3)NS(=O)(=O)C4=CC=C(C=C4)OC(F)(F)F)Cl

Isomeric SMILES

C1=CC=C2C=NC(=CC2=C1)OC3=C(C=C(C=N3)NS(=O)(=O)C4=CC=C(C=C4)OC(F)(F)F)Cl

InChI

InChI=1S/C21H13ClF3N3O4S/c22-18-10-15(28-33(29,30)17-7-5-16(6-8-17)32-21(23,24)25)12-27-20(18)31-19-9-13-3-1-2-4-14(13)11-26-19/h1-12,28H