ethyl 4-[[1-(4-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]amino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[1-(4-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]amino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[1-(4-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]amino]piperidine-1-carboxylate CAS Name: 4-[[1-(4-chlorophenyl)-4-pyrazolo[3,4-d]pyrimidinyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[1-(4-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]amino]piperidine-1-carboxylate Traditional Name: 4-[[1-(4-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C19H21ClN6O2 MolecularWeight: 400.86204

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC2=NC=NC3=C2C=NN3C4=CC=C(C=C4)Cl

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC2=NC=NC3=C2C=NN3C4=CC=C(C=C4)Cl

InChI

InChI=1S/C19H21ClN6O2/c1-2-28-19(27)25-9-7-14(8-10-25)24-17-16-11-23-26(18(16)22-12-21-17)15-5-3-13(20)4-6-15/h3-6,11-12,14H,2,7-10H2,1H3,(H,21,22,24)