3-[2,4-bis(fluoranyl)phenyl]-2-(pyridin-4-ylmethylsulfanyl)quinazolin-4-one

Systemtic Name: 3-[2,4-bis(fluoranyl)phenyl]-2-(pyridin-4-ylmethylsulfanyl)quinazolin-4-one Openeye Name: 3-(2,4-difluorophenyl)-2-(4-pyridylmethylsulfanyl)quinazolin-4-one CAS Name: 3-(2,4-difluorophenyl)-2-(pyridin-4-ylmethylthio)-4-quinazolinone IUPAC Name: 3-(2,4-difluorophenyl)-2-(pyridin-4-ylmethylsulfanyl)quinazolin-4-one Traditional Name: 3-(2,4-difluorophenyl)-2-(4-pyridylmethylthio)quinazolin-4-one Formula: C20H13F2N3OS MolecularWeight: 381.398526

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC3=CC=NC=C3)C4=C(C=C(C=C4)F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC3=CC=NC=C3)C4=C(C=C(C=C4)F)F

InChI

InChI=1S/C20H13F2N3OS/c21-14-5-6-18(16(22)11-14)25-19(26)15-3-1-2-4-17(15)24-20(25)27-12-13-7-9-23-10-8-13/h1-11H,12H2