methyl 3-[(E)-2-(6-bromanyl-4-oxidanylidene-1H-quinazolin-2-yl)-2-cyano-ethenyl]furan-2-carboxylate

Systemtic Name: methyl 3-[(E)-2-(6-bromanyl-4-oxidanylidene-1H-quinazolin-2-yl)-2-cyano-ethenyl]furan-2-carboxylate Openeye Name: methyl 3-[(E)-2-(6-bromo-4-oxo-1H-quinazolin-2-yl)-2-cyano-vinyl]furan-2-carboxylate CAS Name: 3-[(E)-2-(6-bromo-4-oxo-1H-quinazolin-2-yl)-2-cyanoethenyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 3-[(E)-2-(6-bromo-4-oxo-1H-quinazolin-2-yl)-2-cyanoethenyl]furan-2-carboxylate Traditional Name: 3-[(E)-2-(6-bromo-4-keto-1H-quinazolin-2-yl)-2-cyano-vinyl]furan-2-carboxylic acid methyl ester Formula: C17H10BrN3O4 MolecularWeight: 400.183

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CO1)C=C(C#N)C2=NC(=O)C3=C(N2)C=CC(=C3)Br

Isomeric SMILES

COC(=O)C1=C(C=CO1)/C=C(\C#N)/C2=NC(=O)C3=C(N2)C=CC(=C3)Br

InChI

InChI=1S/C17H10BrN3O4/c1-24-17(23)14-9(4-5-25-14)6-10(8-19)15-20-13-3-2-11(18)7-12(13)16(22)21-15/h2-7H,1H3,(H,20,21,22)/b10-6+