ethyl 4-[3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)propanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[3-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)propanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[3-(6-bromo-4-oxo-quinazolin-3-yl)propanoyl]piperazine-1-carboxylate CAS Name: 4-[3-(6-bromo-4-oxo-3-quinazolinyl)-1-oxopropyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-(6-bromo-4-oxoquinazolin-3-yl)propanoyl]piperazine-1-carboxylate Traditional Name: 4-[3-(6-bromo-4-keto-quinazolin-3-yl)propanoyl]piperazine-1-carboxylic acid ethyl ester Formula: C18H21BrN4O4 MolecularWeight: 437.28774

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)CCN2C=NC3=C(C2=O)C=C(C=C3)Br

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)CCN2C=NC3=C(C2=O)C=C(C=C3)Br

InChI

InChI=1S/C18H21BrN4O4/c1-2-27-18(26)22-9-7-21(8-10-22)16(24)5-6-23-12-20-15-4-3-13(19)11-14(15)17(23)25/h3-4,11-12H,2,5-10H2,1H3