3-(3-fluoranyl-4-methyl-phenyl)-2-(2-pyridin-2-ylethylsulfanyl)quinazolin-4-one

Systemtic Name: 3-(3-fluoranyl-4-methyl-phenyl)-2-(2-pyridin-2-ylethylsulfanyl)quinazolin-4-one Openeye Name: 3-(3-fluoro-4-methyl-phenyl)-2-[2-(2-pyridyl)ethylsulfanyl]quinazolin-4-one CAS Name: 3-(3-fluoro-4-methylphenyl)-2-[2-(2-pyridinyl)ethylthio]-4-quinazolinone IUPAC Name: 3-(3-fluoro-4-methylphenyl)-2-(2-pyridin-2-ylethylsulfanyl)quinazolin-4-one Traditional Name: 3-(3-fluoro-4-methyl-phenyl)-2-[2-(2-pyridyl)ethylthio]quinazolin-4-one Formula: C22H18FN3OS MolecularWeight: 391.461223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCCC4=CC=CC=N4)F

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCCC4=CC=CC=N4)F

InChI

InChI=1S/C22H18FN3OS/c1-15-9-10-17(14-19(15)23)26-21(27)18-7-2-3-8-20(18)25-22(26)28-13-11-16-6-4-5-12-24-16/h2-10,12,14H,11,13H2,1H3