2-[[2,3-bis(fluoranyl)phenyl]methylsulfanyl]-3-(5-methylpyridin-2-yl)quinazolin-4-one

Systemtic Name: 2-[[2,3-bis(fluoranyl)phenyl]methylsulfanyl]-3-(5-methylpyridin-2-yl)quinazolin-4-one Openeye Name: 2-[(2,3-difluorophenyl)methylsulfanyl]-3-(5-methyl-2-pyridyl)quinazolin-4-one CAS Name: 2-[(2,3-difluorophenyl)methylthio]-3-(5-methyl-2-pyridinyl)-4-quinazolinone IUPAC Name: 2-[(2,3-difluorophenyl)methylsulfanyl]-3-(5-methylpyridin-2-yl)quinazolin-4-one Traditional Name: 2-[(2,3-difluorobenzyl)thio]-3-(5-methyl-2-pyridyl)quinazolin-4-one Formula: C21H15F2N3OS MolecularWeight: 395.425106

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H15F2N3OS/c1-13-9-10-18(24-11-13)26-20(27)15-6-2-3-8-17(15)25-21(26)28-12-14-5-4-7-16(22)19(14)23/h2-11H,12H2,1H3