N-[(5-bromanyl-2-methoxy-phenyl)methyl]-N-methyl-4-(4-oxidanylidenequinazolin-3-yl)butanamide

Systemtic Name: N-[(5-bromanyl-2-methoxy-phenyl)methyl]-N-methyl-4-(4-oxidanylidenequinazolin-3-yl)butanamide Openeye Name: N-[(5-bromo-2-methoxy-phenyl)methyl]-N-methyl-4-(4-oxoquinazolin-3-yl)butanamide CAS Name: N-[(5-bromo-2-methoxyphenyl)methyl]-N-methyl-4-(4-oxo-3-quinazolinyl)butanamide IUPAC Name: N-[(5-bromo-2-methoxyphenyl)methyl]-N-methyl-4-(4-oxoquinazolin-3-yl)butanamide Traditional Name: N-(5-bromo-2-methoxy-benzyl)-4-(4-ketoquinazolin-3-yl)-N-methyl-butyramide Formula: C21H22BrN3O3 MolecularWeight: 444.32168

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=CC(=C1)Br)OC)C(=O)CCCN2C=NC3=CC=CC=C3C2=O

Isomeric SMILES

CN(CC1=C(C=CC(=C1)Br)OC)C(=O)CCCN2C=NC3=CC=CC=C3C2=O

InChI

InChI=1S/C21H22BrN3O3/c1-24(13-15-12-16(22)9-10-19(15)28-2)20(26)8-5-11-25-14-23-18-7-4-3-6-17(18)21(25)27/h3-4,6-7,9-10,12,14H,5,8,11,13H2,1-2H3