N-[(8-methyl-4-pyrrolidin-1-yl-quinazolin-2-yl)methyl]-2-(trifluoromethyl)benzenesulfonamide

Systemtic Name: N-[(8-methyl-4-pyrrolidin-1-yl-quinazolin-2-yl)methyl]-2-(trifluoromethyl)benzenesulfonamide Openeye Name: N-[(8-methyl-4-pyrrolidin-1-yl-quinazolin-2-yl)methyl]-2-(trifluoromethyl)benzenesulfonamide CAS Name: N-[[8-methyl-4-(1-pyrrolidinyl)-2-quinazolinyl]methyl]-2-(trifluoromethyl)benzenesulfonamide IUPAC Name: N-[(8-methyl-4-pyrrolidin-1-ylquinazolin-2-yl)methyl]-2-(trifluoromethyl)benzenesulfonamide Traditional Name: N-[(8-methyl-4-pyrrolidino-quinazolin-2-yl)methyl]-2-(trifluoromethyl)benzenesulfonamide Formula: C21H21F3N4O2S MolecularWeight: 450.47725

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(N=C2N3CCCC3)CNS(=O)(=O)C4=CC=CC=C4C(F)(F)F

Isomeric SMILES

CC1=CC=CC2=C1N=C(N=C2N3CCCC3)CNS(=O)(=O)C4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C21H21F3N4O2S/c1-14-7-6-8-15-19(14)26-18(27-20(15)28-11-4-5-12-28)13-25-31(29,30)17-10-3-2-9-16(17)21(22,23)24/h2-3,6-10,25H,4-5,11-13H2,1H3