N-[[4-[[3-(trifluoromethyl)phenyl]methylamino]quinazolin-2-yl]methyl]methanesulfonamide

Systemtic Name: N-[[4-[[3-(trifluoromethyl)phenyl]methylamino]quinazolin-2-yl]methyl]methanesulfonamide Openeye Name: N-[[4-[[3-(trifluoromethyl)phenyl]methylamino]quinazolin-2-yl]methyl]methanesulfonamide CAS Name: N-[[4-[[3-(trifluoromethyl)phenyl]methylamino]-2-quinazolinyl]methyl]methanesulfonamide IUPAC Name: N-[[4-[[3-(trifluoromethyl)phenyl]methylamino]quinazolin-2-yl]methyl]methanesulfonamide Traditional Name: N-[[4-[[3-(trifluoromethyl)benzyl]amino]quinazolin-2-yl]methyl]methanesulfonamide Formula: C18H17F3N4O2S MolecularWeight: 410.41339

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NCC1=NC2=CC=CC=C2C(=N1)NCC3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

CS(=O)(=O)NCC1=NC2=CC=CC=C2C(=N1)NCC3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C18H17F3N4O2S/c1-28(26,27)23-11-16-24-15-8-3-2-7-14(15)17(25-16)22-10-12-5-4-6-13(9-12)18(19,20)21/h2-9,23H,10-11H2,1H3,(H,22,24,25)