ethyl 4-[[6,8-bis(bromanyl)-4-oxidanylidene-1H-quinazolin-2-yl]methyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[[6,8-bis(bromanyl)-4-oxidanylidene-1H-quinazolin-2-yl]methyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[(6,8-dibromo-4-oxo-1H-quinazolin-2-yl)methyl]piperazine-1-carboxylate CAS Name: 4-[(6,8-dibromo-4-oxo-1H-quinazolin-2-yl)methyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(6,8-dibromo-4-oxo-1H-quinazolin-2-yl)methyl]piperazine-1-carboxylate Traditional Name: 4-[(6,8-dibromo-4-keto-1H-quinazolin-2-yl)methyl]piperazine-1-carboxylic acid ethyl ester Formula: C16H18Br2N4O3 MolecularWeight: 474.14712

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)CC2=NC(=O)C3=CC(=CC(=C3N2)Br)Br

Isomeric SMILES

CCOC(=O)N1CCN(CC1)CC2=NC(=O)C3=CC(=CC(=C3N2)Br)Br

InChI

InChI=1S/C16H18Br2N4O3/c1-2-25-16(24)22-5-3-21(4-6-22)9-13-19-14-11(15(23)20-13)7-10(17)8-12(14)18/h7-8H,2-6,9H2,1H3,(H,19,20,23)