(4-azanylquinazolin-2-yl)methyl 4-bromanyl-1H-pyrrole-2-carboxylate

Systemtic Name: (4-azanylquinazolin-2-yl)methyl 4-bromanyl-1H-pyrrole-2-carboxylate Openeye Name: (4-aminoquinazolin-2-yl)methyl 4-bromo-1H-pyrrole-2-carboxylate CAS Name: 4-bromo-1H-pyrrole-2-carboxylic acid (4-amino-2-quinazolinyl)methyl ester IUPAC Name: (4-aminoquinazolin-2-yl)methyl 4-bromo-1H-pyrrole-2-carboxylate Traditional Name: 4-bromo-1H-pyrrole-2-carboxylic acid (4-aminoquinazolin-2-yl)methyl ester Formula: C14H11BrN4O2 MolecularWeight: 347.16674

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)COC(=O)C3=CC(=CN3)Br)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)COC(=O)C3=CC(=CN3)Br)N

InChI

InChI=1S/C14H11BrN4O2/c15-8-5-11(17-6-8)14(20)21-7-12-18-10-4-2-1-3-9(10)13(16)19-12/h1-6,17H,7H2,(H2,16,18,19)