ethyl 4-(2-bromanyl-3-cyano-phenyl)-6-(1-methylpiperidin-4-yl)-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylate

Systemtic Name: ethyl 4-(2-bromanyl-3-cyano-phenyl)-6-(1-methylpiperidin-4-yl)-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: ethyl 4-(2-bromo-3-cyano-phenyl)-6-(1-methyl-4-piperidyl)-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 4-(2-bromo-3-cyanophenyl)-6-(1-methyl-4-piperidinyl)-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-bromo-3-cyanophenyl)-6-(1-methylpiperidin-4-yl)-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 4-(2-bromo-3-cyano-phenyl)-6-(1-methyl-4-piperidyl)-2,4-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid ethyl ester Formula: C22H24BrN5O2 MolecularWeight: 470.36226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C2C(=CNN2)C1C3=CC=CC(=C3Br)C#N)C4CCN(CC4)C

Isomeric SMILES

CCOC(=O)C1=C(N=C2C(=CNN2)C1C3=CC=CC(=C3Br)C#N)C4CCN(CC4)C

InChI

InChI=1S/C22H24BrN5O2/c1-3-30-22(29)18-17(15-6-4-5-14(11-24)19(15)23)16-12-25-27-21(16)26-20(18)13-7-9-28(2)10-8-13/h4-6,12-13,17H,3,7-10H2,1-2H3,(H2,25,26,27)