N-[(6-chloranyl-4-pyrrolidin-1-yl-quinazolin-2-yl)methyl]-2-(trifluoromethyl)benzenesulfonamide

Systemtic Name: N-[(6-chloranyl-4-pyrrolidin-1-yl-quinazolin-2-yl)methyl]-2-(trifluoromethyl)benzenesulfonamide Openeye Name: N-[(6-chloro-4-pyrrolidin-1-yl-quinazolin-2-yl)methyl]-2-(trifluoromethyl)benzenesulfonamide CAS Name: N-[[6-chloro-4-(1-pyrrolidinyl)-2-quinazolinyl]methyl]-2-(trifluoromethyl)benzenesulfonamide IUPAC Name: N-[(6-chloro-4-pyrrolidin-1-ylquinazolin-2-yl)methyl]-2-(trifluoromethyl)benzenesulfonamide Traditional Name: N-[(6-chloro-4-pyrrolidino-quinazolin-2-yl)methyl]-2-(trifluoromethyl)benzenesulfonamide Formula: C20H18ClF3N4O2S MolecularWeight: 470.89573

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC(=NC3=C2C=C(C=C3)Cl)CNS(=O)(=O)C4=CC=CC=C4C(F)(F)F

Isomeric SMILES

C1CCN(C1)C2=NC(=NC3=C2C=C(C=C3)Cl)CNS(=O)(=O)C4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C20H18ClF3N4O2S/c21-13-7-8-16-14(11-13)19(28-9-3-4-10-28)27-18(26-16)12-25-31(29,30)17-6-2-1-5-15(17)20(22,23)24/h1-2,5-8,11,25H,3-4,9-10,12H2