ethyl 4-(phenethylamino)-1-[(E)-2-phenylethenyl]pyrazolo[3,4-b]pyridine-5-carboxylate

Systemtic Name: ethyl 4-(phenethylamino)-1-[(E)-2-phenylethenyl]pyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: ethyl 4-(phenethylamino)-1-[(E)-styryl]pyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 4-(phenethylamino)-1-[(E)-2-phenylethenyl]-5-pyrazolo[3,4-b]pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(phenethylamino)-1-[(E)-2-phenylethenyl]pyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 4-(phenethylamino)-1-[(E)-styryl]pyrazolo[3,4-b]pyridine-5-carboxylic acid ethyl ester Formula: C25H24N4O2 MolecularWeight: 412.48366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2C(=C1NCCC3=CC=CC=C3)C=NN2C=CC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CN=C2C(=C1NCCC3=CC=CC=C3)C=NN2/C=C/C4=CC=CC=C4

InChI

InChI=1S/C25H24N4O2/c1-2-31-25(30)22-17-27-24-21(23(22)26-15-13-19-9-5-3-6-10-19)18-28-29(24)16-14-20-11-7-4-8-12-20/h3-12,14,16-18H,2,13,15H2,1H3,(H,26,27)/b16-14+