methyl 2-[(6-bromanylpyrazolo[1,5-a]pyrimidin-3-yl)carbonylamino]benzoate

Systemtic Name: methyl 2-[(6-bromanylpyrazolo[1,5-a]pyrimidin-3-yl)carbonylamino]benzoate Openeye Name: methyl 2-[(6-bromopyrazolo[1,5-a]pyrimidine-3-carbonyl)amino]benzoate CAS Name: 2-[[(6-bromo-3-pyrazolo[1,5-a]pyrimidinyl)-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[(6-bromopyrazolo[1,5-a]pyrimidine-3-carbonyl)amino]benzoate Traditional Name: 2-[(6-bromopyrazolo[1,5-a]pyrimidine-3-carbonyl)amino]benzoic acid methyl ester Formula: C15H11BrN4O3 MolecularWeight: 375.17684

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)C2=C3N=CC(=CN3N=C2)Br

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)C2=C3N=CC(=CN3N=C2)Br

InChI

InChI=1S/C15H11BrN4O3/c1-23-15(22)10-4-2-3-5-12(10)19-14(21)11-7-18-20-8-9(16)6-17-13(11)20/h2-8H,1H3,(H,19,21)