2-(4-bromophenyl)-3-[(5-methoxy-2-oxidanyl-phenyl)methylamino]quinazolin-4-one

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)O)CNN2C(=NC3=CC=CC=C3C2=O)C4=CC=C(C=C4)Br

Isomeric SMILES

COC1=CC(=C(C=C1)O)CNN2C(=NC3=CC=CC=C3C2=O)C4=CC=C(C=C4)Br

InChI

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