(8-methyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl 4-bromanyl-1H-pyrrole-2-carboxylate

Systemtic Name: (8-methyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl 4-bromanyl-1H-pyrrole-2-carboxylate Openeye Name: (8-methyl-4-oxo-1H-quinazolin-2-yl)methyl 4-bromo-1H-pyrrole-2-carboxylate CAS Name: 4-bromo-1H-pyrrole-2-carboxylic acid (8-methyl-4-oxo-1H-quinazolin-2-yl)methyl ester IUPAC Name: (8-methyl-4-oxo-1H-quinazolin-2-yl)methyl 4-bromo-1H-pyrrole-2-carboxylate Traditional Name: 4-bromo-1H-pyrrole-2-carboxylic acid (4-keto-8-methyl-1H-quinazolin-2-yl)methyl ester Formula: C15H12BrN3O3 MolecularWeight: 362.17808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1NC(=NC2=O)COC(=O)C3=CC(=CN3)Br

Isomeric SMILES

CC1=CC=CC2=C1NC(=NC2=O)COC(=O)C3=CC(=CN3)Br

InChI

InChI=1S/C15H12BrN3O3/c1-8-3-2-4-10-13(8)18-12(19-14(10)20)7-22-15(21)11-5-9(16)6-17-11/h2-6,17H,7H2,1H3,(H,18,19,20)