2-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]-3-(4-fluorophenyl)quinazolin-4-one

Systemtic Name: 2-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]-3-(4-fluorophenyl)quinazolin-4-one Openeye Name: 2-[(3-fluoro-4-methoxy-phenyl)methylsulfanyl]-3-(4-fluorophenyl)quinazolin-4-one CAS Name: 2-[(3-fluoro-4-methoxyphenyl)methylthio]-3-(4-fluorophenyl)-4-quinazolinone IUPAC Name: 2-[(3-fluoro-4-methoxyphenyl)methylsulfanyl]-3-(4-fluorophenyl)quinazolin-4-one Traditional Name: 2-[(3-fluoro-4-methoxy-benzyl)thio]-3-(4-fluorophenyl)quinazolin-4-one Formula: C22H16F2N2O2S MolecularWeight: 410.436446

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)F)F

Isomeric SMILES

COC1=C(C=C(C=C1)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)F)F

InChI

InChI=1S/C22H16F2N2O2S/c1-28-20-11-6-14(12-18(20)24)13-29-22-25-19-5-3-2-4-17(19)21(27)26(22)16-9-7-15(23)8-10-16/h2-12H,13H2,1H3