ethyl 6-(3-bromophenyl)-1-(4,6-dimethylpyrimidin-2-yl)-3-methyl-pyrazolo[3,4-b]pyridine-4-carboxylate

Systemtic Name: ethyl 6-(3-bromophenyl)-1-(4,6-dimethylpyrimidin-2-yl)-3-methyl-pyrazolo[3,4-b]pyridine-4-carboxylate Openeye Name: ethyl 6-(3-bromophenyl)-1-(4,6-dimethylpyrimidin-2-yl)-3-methyl-pyrazolo[3,4-b]pyridine-4-carboxylate CAS Name: 6-(3-bromophenyl)-1-(4,6-dimethyl-2-pyrimidinyl)-3-methyl-4-pyrazolo[3,4-b]pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-(3-bromophenyl)-1-(4,6-dimethylpyrimidin-2-yl)-3-methylpyrazolo[3,4-b]pyridine-4-carboxylate Traditional Name: 6-(3-bromophenyl)-1-(4,6-dimethylpyrimidin-2-yl)-3-methyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid ethyl ester Formula: C22H20BrN5O2 MolecularWeight: 466.3305

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=NC2=C1C(=NN2C3=NC(=CC(=N3)C)C)C)C4=CC(=CC=C4)Br

Isomeric SMILES

CCOC(=O)C1=CC(=NC2=C1C(=NN2C3=NC(=CC(=N3)C)C)C)C4=CC(=CC=C4)Br

InChI

InChI=1S/C22H20BrN5O2/c1-5-30-21(29)17-11-18(15-7-6-8-16(23)10-15)26-20-19(17)14(4)27-28(20)22-24-12(2)9-13(3)25-22/h6-11H,5H2,1-4H3