3-(4-methylpyridin-2-yl)-2-[[4-(trifluoromethyloxy)phenyl]methylsulfanyl]quinazolin-4-one

Systemtic Name: 3-(4-methylpyridin-2-yl)-2-[[4-(trifluoromethyloxy)phenyl]methylsulfanyl]quinazolin-4-one Openeye Name: 3-(4-methyl-2-pyridyl)-2-[[4-(trifluoromethoxy)phenyl]methylsulfanyl]quinazolin-4-one CAS Name: 3-(4-methyl-2-pyridinyl)-2-[[4-(trifluoromethoxy)phenyl]methylthio]-4-quinazolinone IUPAC Name: 3-(4-methylpyridin-2-yl)-2-[[4-(trifluoromethoxy)phenyl]methylsulfanyl]quinazolin-4-one Traditional Name: 3-(4-methyl-2-pyridyl)-2-[[4-(trifluoromethoxy)benzyl]thio]quinazolin-4-one Formula: C22H16F3N3O2S MolecularWeight: 443.44155

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H16F3N3O2S/c1-14-10-11-26-19(12-14)28-20(29)17-4-2-3-5-18(17)27-21(28)31-13-15-6-8-16(9-7-15)30-22(23,24)25/h2-12H,13H2,1H3