cyclopropylmethyl 1-(2-chloranyl-2-phenyl-ethyl)-4-(phenethylamino)pyrazolo[3,4-b]pyridine-5-carboxylate

Systemtic Name: cyclopropylmethyl 1-(2-chloranyl-2-phenyl-ethyl)-4-(phenethylamino)pyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: cyclopropylmethyl 1-(2-chloro-2-phenyl-ethyl)-4-(phenethylamino)pyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 1-(2-chloro-2-phenylethyl)-4-(phenethylamino)-5-pyrazolo[3,4-b]pyridinecarboxylic acid cyclopropylmethyl ester IUPAC Name: cyclopropylmethyl 1-(2-chloro-2-phenylethyl)-4-(phenethylamino)pyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 1-(2-chloro-2-phenyl-ethyl)-4-(phenethylamino)pyrazolo[3,4-b]pyridine-5-carboxylic acid cyclopropylmethyl ester Formula: C27H27ClN4O2 MolecularWeight: 474.98188

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1COC(=O)C2=CN=C3C(=C2NCCC4=CC=CC=C4)C=NN3CC(C5=CC=CC=C5)Cl

Isomeric SMILES

C1CC1COC(=O)C2=CN=C3C(=C2NCCC4=CC=CC=C4)C=NN3CC(C5=CC=CC=C5)Cl

InChI

InChI=1S/C27H27ClN4O2/c28-24(21-9-5-2-6-10-21)17-32-26-22(16-31-32)25(29-14-13-19-7-3-1-4-8-19)23(15-30-26)27(33)34-18-20-11-12-20/h1-10,15-16,20,24H,11-14,17-18H2,(H,29,30)