3-[(6-bromanylpyrazolo[1,5-a]pyrimidin-2-yl)carbonylamino]-4-methyl-benzoate

Systemtic Name: 3-[(6-bromanylpyrazolo[1,5-a]pyrimidin-2-yl)carbonylamino]-4-methyl-benzoate Openeye Name: 3-[(6-bromopyrazolo[1,5-a]pyrimidine-2-carbonyl)amino]-4-methyl-benzoate CAS Name: 3-[[(6-bromo-2-pyrazolo[1,5-a]pyrimidinyl)-oxomethyl]amino]-4-methylbenzoate IUPAC Name: 3-[(6-bromopyrazolo[1,5-a]pyrimidine-2-carbonyl)amino]-4-methylbenzoate Traditional Name: 3-[(6-bromopyrazolo[1,5-a]pyrimidine-2-carbonyl)amino]-4-methyl-benzoate Formula: C15H10BrN4O3- MolecularWeight: 374.1689

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)[O-])NC(=O)C2=NN3C=C(C=NC3=C2)Br

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)[O-])NC(=O)C2=NN3C=C(C=NC3=C2)Br

InChI

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