3-[(5-bromanyl-2-fluoranyl-phenyl)methylamino]-2-(3,4,5-trimethoxyphenyl)quinazolin-4-one

Systemtic Name: 3-[(5-bromanyl-2-fluoranyl-phenyl)methylamino]-2-(3,4,5-trimethoxyphenyl)quinazolin-4-one Openeye Name: 3-[(5-bromo-2-fluoro-phenyl)methylamino]-2-(3,4,5-trimethoxyphenyl)quinazolin-4-one CAS Name: 3-[(5-bromo-2-fluorophenyl)methylamino]-2-(3,4,5-trimethoxyphenyl)-4-quinazolinone IUPAC Name: 3-[(5-bromo-2-fluorophenyl)methylamino]-2-(3,4,5-trimethoxyphenyl)quinazolin-4-one Traditional Name: 3-[(5-bromo-2-fluoro-benzyl)amino]-2-(3,4,5-trimethoxyphenyl)quinazolin-4-one Formula: C24H21BrFN3O4 MolecularWeight: 514.343643

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=NC3=CC=CC=C3C(=O)N2NCC4=C(C=CC(=C4)Br)F

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=NC3=CC=CC=C3C(=O)N2NCC4=C(C=CC(=C4)Br)F

InChI

InChI=1S/C24H21BrFN3O4/c1-31-20-11-14(12-21(32-2)22(20)33-3)23-28-19-7-5-4-6-17(19)24(30)29(23)27-13-15-10-16(25)8-9-18(15)26/h4-12,27H,13H2,1-3H3