3-(2-methoxy-5-methyl-phenyl)-2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]quinazolin-4-one

Systemtic Name: 3-(2-methoxy-5-methyl-phenyl)-2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]quinazolin-4-one Openeye Name: 3-(2-methoxy-5-methyl-phenyl)-2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]quinazolin-4-one CAS Name: 3-(2-methoxy-5-methylphenyl)-2-[[3-(trifluoromethyl)phenyl]methylthio]-4-quinazolinone IUPAC Name: 3-(2-methoxy-5-methylphenyl)-2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]quinazolin-4-one Traditional Name: 3-(2-methoxy-5-methyl-phenyl)-2-[[3-(trifluoromethyl)benzyl]thio]quinazolin-4-one Formula: C24H19F3N2O2S MolecularWeight: 456.48007

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)N2C(=O)C3=CC=CC=C3N=C2SCC4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

CC1=CC(=C(C=C1)OC)N2C(=O)C3=CC=CC=C3N=C2SCC4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C24H19F3N2O2S/c1-15-10-11-21(31-2)20(12-15)29-22(30)18-8-3-4-9-19(18)28-23(29)32-14-16-6-5-7-17(13-16)24(25,26)27/h3-13H,14H2,1-2H3