2-[2-(3-bromanylphenoxy)ethylsulfanyl]-3-(4-fluorophenyl)quinazolin-4-one

Systemtic Name: 2-[2-(3-bromanylphenoxy)ethylsulfanyl]-3-(4-fluorophenyl)quinazolin-4-one Openeye Name: 2-[2-(3-bromophenoxy)ethylsulfanyl]-3-(4-fluorophenyl)quinazolin-4-one CAS Name: 2-[2-(3-bromophenoxy)ethylthio]-3-(4-fluorophenyl)-4-quinazolinone IUPAC Name: 2-[2-(3-bromophenoxy)ethylsulfanyl]-3-(4-fluorophenyl)quinazolin-4-one Traditional Name: 2-[2-(3-bromophenoxy)ethylthio]-3-(4-fluorophenyl)quinazolin-4-one Formula: C22H16BrFN2O2S MolecularWeight: 471.342043

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCCOC3=CC(=CC=C3)Br)C4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCCOC3=CC(=CC=C3)Br)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H16BrFN2O2S/c23-15-4-3-5-18(14-15)28-12-13-29-22-25-20-7-2-1-6-19(20)21(27)26(22)17-10-8-16(24)9-11-17/h1-11,14H,12-13H2