2-[(6-fluoranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-3-(3-fluoranyl-4-methyl-phenyl)quinazolin-4-one

Systemtic Name: 2-[(6-fluoranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-3-(3-fluoranyl-4-methyl-phenyl)quinazolin-4-one Openeye Name: 2-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-3-(3-fluoro-4-methyl-phenyl)quinazolin-4-one CAS Name: 2-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylthio]-3-(3-fluoro-4-methylphenyl)-4-quinazolinone IUPAC Name: 2-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-3-(3-fluoro-4-methylphenyl)quinazolin-4-one Traditional Name: 2-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methylthio]-3-(3-fluoro-4-methyl-phenyl)quinazolin-4-one Formula: C24H18F2N2O3S MolecularWeight: 452.473126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=C5C(=CC(=C4)F)COCO5)F

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=C5C(=CC(=C4)F)COCO5)F

InChI

InChI=1S/C24H18F2N2O3S/c1-14-6-7-18(10-20(14)26)28-23(29)19-4-2-3-5-21(19)27-24(28)32-12-16-9-17(25)8-15-11-30-13-31-22(15)16/h2-10H,11-13H2,1H3