3-[(5-bromanyl-2-oxidanyl-phenyl)methylamino]-2-(4-methoxyphenyl)quinazolin-4-one

Systemtic Name: 3-[(5-bromanyl-2-oxidanyl-phenyl)methylamino]-2-(4-methoxyphenyl)quinazolin-4-one Openeye Name: 3-[(5-bromo-2-hydroxy-phenyl)methylamino]-2-(4-methoxyphenyl)quinazolin-4-one CAS Name: 3-[(5-bromo-2-hydroxyphenyl)methylamino]-2-(4-methoxyphenyl)-4-quinazolinone IUPAC Name: 3-[(5-bromo-2-hydroxyphenyl)methylamino]-2-(4-methoxyphenyl)quinazolin-4-one Traditional Name: 3-[(5-bromo-2-hydroxy-benzyl)amino]-2-(4-methoxyphenyl)quinazolin-4-one Formula: C22H18BrN3O3 MolecularWeight: 452.30062

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=O)N2NCC4=C(C=CC(=C4)Br)O

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=O)N2NCC4=C(C=CC(=C4)Br)O

InChI

InChI=1S/C22H18BrN3O3/c1-29-17-9-6-14(7-10-17)21-25-19-5-3-2-4-18(19)22(28)26(21)24-13-15-12-16(23)8-11-20(15)27/h2-12,24,27H,13H2,1H3