propan-2-yl 1-(2-chloranyl-2-phenyl-ethyl)-4-(cyclopropylamino)pyrazolo[3,4-b]pyridine-5-carboxylate

Systemtic Name: propan-2-yl 1-(2-chloranyl-2-phenyl-ethyl)-4-(cyclopropylamino)pyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: isopropyl 1-(2-chloro-2-phenyl-ethyl)-4-(cyclopropylamino)pyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 1-(2-chloro-2-phenylethyl)-4-(cyclopropylamino)-5-pyrazolo[3,4-b]pyridinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 1-(2-chloro-2-phenylethyl)-4-(cyclopropylamino)pyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 1-(2-chloro-2-phenyl-ethyl)-4-(cyclopropylamino)pyrazolo[3,4-b]pyridine-5-carboxylic acid isopropyl ester Formula: C21H23ClN4O2 MolecularWeight: 398.88592

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C1=CN=C2C(=C1NC3CC3)C=NN2CC(C4=CC=CC=C4)Cl

Isomeric SMILES

CC(C)OC(=O)C1=CN=C2C(=C1NC3CC3)C=NN2CC(C4=CC=CC=C4)Cl

InChI

InChI=1S/C21H23ClN4O2/c1-13(2)28-21(27)17-10-23-20-16(19(17)25-15-8-9-15)11-24-26(20)12-18(22)14-6-4-3-5-7-14/h3-7,10-11,13,15,18H,8-9,12H2,1-2H3,(H,23,25)