ethyl (2E)-2-[[4-(6-bromanyl-2-methyl-4-oxidanylidene-quinazolin-3-yl)phenyl]hydrazinylidene]-2-cyano-ethanoate

Systemtic Name: ethyl (2E)-2-[[4-(6-bromanyl-2-methyl-4-oxidanylidene-quinazolin-3-yl)phenyl]hydrazinylidene]-2-cyano-ethanoate Openeye Name: ethyl (2E)-2-[[4-(6-bromo-2-methyl-4-oxo-quinazolin-3-yl)phenyl]hydrazono]-2-cyano-acetate CAS Name: (2E)-2-[[4-(6-bromo-2-methyl-4-oxo-3-quinazolinyl)phenyl]hydrazinylidene]-2-cyanoacetic acid ethyl ester IUPAC Name: ethyl (2E)-2-[[4-(6-bromo-2-methyl-4-oxoquinazolin-3-yl)phenyl]hydrazinylidene]-2-cyanoacetate Traditional Name: (2E)-2-[[4-(6-bromo-4-keto-2-methyl-quinazolin-3-yl)phenyl]hydrazono]-2-cyano-acetic acid ethyl ester Formula: C20H16BrN5O3 MolecularWeight: 454.27674

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=NNC1=CC=C(C=C1)N2C(=NC3=C(C2=O)C=C(C=C3)Br)C)C#N

Isomeric SMILES

CCOC(=O)/C(=N/NC1=CC=C(C=C1)N2C(=NC3=C(C2=O)C=C(C=C3)Br)C)/C#N

InChI

InChI=1S/C20H16BrN5O3/c1-3-29-20(28)18(11-22)25-24-14-5-7-15(8-6-14)26-12(2)23-17-9-4-13(21)10-16(17)19(26)27/h4-10,24H,3H2,1-2H3/b25-18+