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

Systemtic Name: 2-methylsulfanyl-N-[[4-[[3-(trifluoromethyl)phenyl]methylamino]quinazolin-2-yl]methyl]benzamide Openeye Name: 2-methylsulfanyl-N-[[4-[[3-(trifluoromethyl)phenyl]methylamino]quinazolin-2-yl]methyl]benzamide CAS Name: 2-(methylthio)-N-[[4-[[3-(trifluoromethyl)phenyl]methylamino]-2-quinazolinyl]methyl]benzamide IUPAC Name: 2-methylsulfanyl-N-[[4-[[3-(trifluoromethyl)phenyl]methylamino]quinazolin-2-yl]methyl]benzamide Traditional Name: 2-(methylthio)-N-[[4-[[3-(trifluoromethyl)benzyl]amino]quinazolin-2-yl]methyl]benzamide Formula: C25H21F3N4OS MolecularWeight: 482.52065

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1C(=O)NCC2=NC3=CC=CC=C3C(=N2)NCC4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

CSC1=CC=CC=C1C(=O)NCC2=NC3=CC=CC=C3C(=N2)NCC4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C25H21F3N4OS/c1-34-21-12-5-3-10-19(21)24(33)30-15-22-31-20-11-4-2-9-18(20)23(32-22)29-14-16-7-6-8-17(13-16)25(26,27)28/h2-13H,14-15H2,1H3,(H,30,33)(H,29,31,32)