ethyl 1-(2-cyanoethyl)-6-(4-cyclohexylphenyl)-3-methyl-pyrazolo[3,4-b]pyridine-4-carboxylate

Systemtic Name: ethyl 1-(2-cyanoethyl)-6-(4-cyclohexylphenyl)-3-methyl-pyrazolo[3,4-b]pyridine-4-carboxylate Openeye Name: ethyl 1-(2-cyanoethyl)-6-(4-cyclohexylphenyl)-3-methyl-pyrazolo[3,4-b]pyridine-4-carboxylate CAS Name: 1-(2-cyanoethyl)-6-(4-cyclohexylphenyl)-3-methyl-4-pyrazolo[3,4-b]pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-cyanoethyl)-6-(4-cyclohexylphenyl)-3-methylpyrazolo[3,4-b]pyridine-4-carboxylate Traditional Name: 1-(2-cyanoethyl)-6-(4-cyclohexylphenyl)-3-methyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid ethyl ester Formula: C25H28N4O2 MolecularWeight: 416.51542

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=NC2=C1C(=NN2CCC#N)C)C3=CC=C(C=C3)C4CCCCC4

Isomeric SMILES

CCOC(=O)C1=CC(=NC2=C1C(=NN2CCC#N)C)C3=CC=C(C=C3)C4CCCCC4

InChI

InChI=1S/C25H28N4O2/c1-3-31-25(30)21-16-22(27-24-23(21)17(2)28-29(24)15-7-14-26)20-12-10-19(11-13-20)18-8-5-4-6-9-18/h10-13,16,18H,3-9,15H2,1-2H3