N-propan-2-yl-1-[2-[[[2-(trifluoromethyl)quinazolin-4-yl]amino]methyl]phenyl]methanesulfonamide

Systemtic Name: N-propan-2-yl-1-[2-[[[2-(trifluoromethyl)quinazolin-4-yl]amino]methyl]phenyl]methanesulfonamide Openeye Name: N-isopropyl-1-[2-[[[2-(trifluoromethyl)quinazolin-4-yl]amino]methyl]phenyl]methanesulfonamide CAS Name: N-propan-2-yl-1-[2-[[[2-(trifluoromethyl)-4-quinazolinyl]amino]methyl]phenyl]methanesulfonamide IUPAC Name: N-propan-2-yl-1-[2-[[[2-(trifluoromethyl)quinazolin-4-yl]amino]methyl]phenyl]methanesulfonamide Traditional Name: N-isopropyl-1-[2-[[[2-(trifluoromethyl)quinazolin-4-yl]amino]methyl]phenyl]methanesulfonamide Formula: C20H21F3N4O2S MolecularWeight: 438.46655

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NS(=O)(=O)CC1=CC=CC=C1CNC2=NC(=NC3=CC=CC=C32)C(F)(F)F

Isomeric SMILES

CC(C)NS(=O)(=O)CC1=CC=CC=C1CNC2=NC(=NC3=CC=CC=C32)C(F)(F)F

InChI

InChI=1S/C20H21F3N4O2S/c1-13(2)27-30(28,29)12-15-8-4-3-7-14(15)11-24-18-16-9-5-6-10-17(16)25-19(26-18)20(21,22)23/h3-10,13,27H,11-12H2,1-2H3,(H,24,25,26)