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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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