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

Systemtic Name: cyclopropylmethyl 1-(2-chloranyl-2-phenyl-ethyl)-4-(propylamino)pyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: cyclopropylmethyl 1-(2-chloro-2-phenyl-ethyl)-4-(propylamino)pyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 1-(2-chloro-2-phenylethyl)-4-(propylamino)-5-pyrazolo[3,4-b]pyridinecarboxylic acid cyclopropylmethyl ester IUPAC Name: cyclopropylmethyl 1-(2-chloro-2-phenylethyl)-4-(propylamino)pyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 1-(2-chloro-2-phenyl-ethyl)-4-(propylamino)pyrazolo[3,4-b]pyridine-5-carboxylic acid cyclopropylmethyl ester Formula: C22H25ClN4O2 MolecularWeight: 412.9125

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=C2C=NN(C2=NC=C1C(=O)OCC3CC3)CC(C4=CC=CC=C4)Cl

Isomeric SMILES

CCCNC1=C2C=NN(C2=NC=C1C(=O)OCC3CC3)CC(C4=CC=CC=C4)Cl

InChI

InChI=1S/C22H25ClN4O2/c1-2-10-24-20-17-12-26-27(13-19(23)16-6-4-3-5-7-16)21(17)25-11-18(20)22(28)29-14-15-8-9-15/h3-7,11-12,15,19H,2,8-10,13-14H2,1H3,(H,24,25)