3-(2-propan-2-ylphenyl)-2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]quinazolin-4-one

Systemtic Name: 3-(2-propan-2-ylphenyl)-2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]quinazolin-4-one Openeye Name: 3-(2-isopropylphenyl)-2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]quinazolin-4-one CAS Name: 3-(2-propan-2-ylphenyl)-2-[[3-(trifluoromethyl)phenyl]methylthio]-4-quinazolinone IUPAC Name: 3-(2-propan-2-ylphenyl)-2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]quinazolin-4-one Traditional Name: 3-o-cumenyl-2-[[3-(trifluoromethyl)benzyl]thio]quinazolin-4-one Formula: C25H21F3N2OS MolecularWeight: 454.50725

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SCC4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

CC(C)C1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SCC4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C25H21F3N2OS/c1-16(2)19-10-4-6-13-22(19)30-23(31)20-11-3-5-12-21(20)29-24(30)32-15-17-8-7-9-18(14-17)25(26,27)28/h3-14,16H,15H2,1-2H3