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

Systemtic Name: 2-[(4-bromanyl-2-fluoranyl-phenyl)methylsulfanyl]-3-(4-methylpyridin-2-yl)quinazolin-4-one Openeye Name: 2-[(4-bromo-2-fluoro-phenyl)methylsulfanyl]-3-(4-methyl-2-pyridyl)quinazolin-4-one CAS Name: 2-[(4-bromo-2-fluorophenyl)methylthio]-3-(4-methyl-2-pyridinyl)-4-quinazolinone IUPAC Name: 2-[(4-bromo-2-fluorophenyl)methylsulfanyl]-3-(4-methylpyridin-2-yl)quinazolin-4-one Traditional Name: 2-[(4-bromo-2-fluoro-benzyl)thio]-3-(4-methyl-2-pyridyl)quinazolin-4-one Formula: C21H15BrFN3OS MolecularWeight: 456.330703

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H15BrFN3OS/c1-13-8-9-24-19(10-13)26-20(27)16-4-2-3-5-18(16)25-21(26)28-12-14-6-7-15(22)11-17(14)23/h2-11H,12H2,1H3