methyl 3-bromanyl-5-(1-ethylpyrazol-3-yl)pyrazolo[1,5-a]pyrimidine-7-carboxylate

Systemtic Name: methyl 3-bromanyl-5-(1-ethylpyrazol-3-yl)pyrazolo[1,5-a]pyrimidine-7-carboxylate Openeye Name: methyl 3-bromo-5-(1-ethylpyrazol-3-yl)pyrazolo[1,5-a]pyrimidine-7-carboxylate CAS Name: 3-bromo-5-(1-ethyl-3-pyrazolyl)-7-pyrazolo[1,5-a]pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 3-bromo-5-(1-ethylpyrazol-3-yl)pyrazolo[1,5-a]pyrimidine-7-carboxylate Traditional Name: 3-bromo-5-(1-ethylpyrazol-3-yl)pyrazolo[1,5-a]pyrimidine-7-carboxylic acid methyl ester Formula: C13H12BrN5O2 MolecularWeight: 350.17068

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=CC(=N1)C2=NC3=C(C=NN3C(=C2)C(=O)OC)Br

Isomeric SMILES

CCN1C=CC(=N1)C2=NC3=C(C=NN3C(=C2)C(=O)OC)Br

InChI

InChI=1S/C13H12BrN5O2/c1-3-18-5-4-9(17-18)10-6-11(13(20)21-2)19-12(16-10)8(14)7-15-19/h4-7H,3H2,1-2H3