6-bromanyl-N-[(4-methoxy-3-oxidanyl-phenyl)methyl]-4-oxidanylidene-1H-quinazoline-2-carboxamide

Systemtic Name: 6-bromanyl-N-[(4-methoxy-3-oxidanyl-phenyl)methyl]-4-oxidanylidene-1H-quinazoline-2-carboxamide Openeye Name: 6-bromo-N-[(3-hydroxy-4-methoxy-phenyl)methyl]-4-oxo-1H-quinazoline-2-carboxamide CAS Name: 6-bromo-N-[(3-hydroxy-4-methoxyphenyl)methyl]-4-oxo-1H-quinazoline-2-carboxamide IUPAC Name: 6-bromo-N-[(3-hydroxy-4-methoxyphenyl)methyl]-4-oxo-1H-quinazoline-2-carboxamide Traditional Name: 6-bromo-N-(3-hydroxy-4-methoxy-benzyl)-4-keto-1H-quinazoline-2-carboxamide Formula: C17H14BrN3O4 MolecularWeight: 404.21476

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)C2=NC(=O)C3=C(N2)C=CC(=C3)Br)O

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)C2=NC(=O)C3=C(N2)C=CC(=C3)Br)O

InChI

InChI=1S/C17H14BrN3O4/c1-25-14-5-2-9(6-13(14)22)8-19-17(24)15-20-12-4-3-10(18)7-11(12)16(23)21-15/h2-7,22H,8H2,1H3,(H,19,24)(H,20,21,23)