4-bromanyl-N-[4-(quinazolin-2-ylamino)cyclohexyl]-2-(trifluoromethyloxy)benzenesulfonamide

Systemtic Name: 4-bromanyl-N-[4-(quinazolin-2-ylamino)cyclohexyl]-2-(trifluoromethyloxy)benzenesulfonamide Openeye Name: 4-bromo-N-[4-(quinazolin-2-ylamino)cyclohexyl]-2-(trifluoromethoxy)benzenesulfonamide CAS Name: 4-bromo-N-[4-(2-quinazolinylamino)cyclohexyl]-2-(trifluoromethoxy)benzenesulfonamide IUPAC Name: 4-bromo-N-[4-(quinazolin-2-ylamino)cyclohexyl]-2-(trifluoromethoxy)benzenesulfonamide Traditional Name: 4-bromo-N-[4-(quinazolin-2-ylamino)cyclohexyl]-2-(trifluoromethoxy)benzenesulfonamide Formula: C21H20BrF3N4O3S MolecularWeight: 545.37271

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1NC2=NC3=CC=CC=C3C=N2)NS(=O)(=O)C4=C(C=C(C=C4)Br)OC(F)(F)F

Isomeric SMILES

C1CC(CCC1NC2=NC3=CC=CC=C3C=N2)NS(=O)(=O)C4=C(C=C(C=C4)Br)OC(F)(F)F

InChI

InChI=1S/C21H20BrF3N4O3S/c22-14-5-10-19(18(11-14)32-21(23,24)25)33(30,31)29-16-8-6-15(7-9-16)27-20-26-12-13-3-1-2-4-17(13)28-20/h1-5,10-12,15-16,29H,6-9H2,(H,26,27,28)