N-[[4-[[3-(trifluoromethyl)phenyl]methylamino]quinazolin-2-yl]methyl]propane-1-sulfonamide

Systemtic Name: N-[[4-[[3-(trifluoromethyl)phenyl]methylamino]quinazolin-2-yl]methyl]propane-1-sulfonamide Openeye Name: N-[[4-[[3-(trifluoromethyl)phenyl]methylamino]quinazolin-2-yl]methyl]propane-1-sulfonamide CAS Name: N-[[4-[[3-(trifluoromethyl)phenyl]methylamino]-2-quinazolinyl]methyl]-1-propanesulfonamide IUPAC Name: N-[[4-[[3-(trifluoromethyl)phenyl]methylamino]quinazolin-2-yl]methyl]propane-1-sulfonamide Traditional Name: N-[[4-[[3-(trifluoromethyl)benzyl]amino]quinazolin-2-yl]methyl]propane-1-sulfonamide Formula: C20H21F3N4O2S MolecularWeight: 438.46655

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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