2-[(4-bromophenyl)methylsulfanyl]-3-[(4-fluorophenyl)methyl]quinazolin-4-one

Systemtic Name: 2-[(4-bromophenyl)methylsulfanyl]-3-[(4-fluorophenyl)methyl]quinazolin-4-one Openeye Name: 2-[(4-bromophenyl)methylsulfanyl]-3-[(4-fluorophenyl)methyl]quinazolin-4-one CAS Name: 2-[(4-bromophenyl)methylthio]-3-[(4-fluorophenyl)methyl]-4-quinazolinone IUPAC Name: 2-[(4-bromophenyl)methylsulfanyl]-3-[(4-fluorophenyl)methyl]quinazolin-4-one Traditional Name: 2-[(4-bromobenzyl)thio]-3-(4-fluorobenzyl)quinazolin-4-one Formula: C22H16BrFN2OS MolecularWeight: 455.342643

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC3=CC=C(C=C3)Br)CC4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC3=CC=C(C=C3)Br)CC4=CC=C(C=C4)F

InChI

InChI=1S/C22H16BrFN2OS/c23-17-9-5-16(6-10-17)14-28-22-25-20-4-2-1-3-19(20)21(27)26(22)13-15-7-11-18(24)12-8-15/h1-12H,13-14H2