tert-butyl 4-[5-(4-chlorophenyl)-1-(2-hydroxyethyl)-4-pyridin-4-yl-pyrazol-3-yl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[5-(4-chlorophenyl)-1-(2-hydroxyethyl)-4-pyridin-4-yl-pyrazol-3-yl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[5-(4-chlorophenyl)-1-(2-hydroxyethyl)-4-(4-pyridyl)pyrazol-3-yl]piperazine-1-carboxylate CAS Name: 4-[5-(4-chlorophenyl)-1-(2-hydroxyethyl)-4-pyridin-4-yl-3-pyrazolyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[5-(4-chlorophenyl)-1-(2-hydroxyethyl)-4-pyridin-4-ylpyrazol-3-yl]piperazine-1-carboxylate Traditional Name: 4-[5-(4-chlorophenyl)-1-(2-hydroxyethyl)-4-(4-pyridyl)pyrazol-3-yl]piperazine-1-carboxylic acid tert-butyl ester Formula: C25H30ClN5O3 MolecularWeight: 483.9904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=NN(C(=C2C3=CC=NC=C3)C4=CC=C(C=C4)Cl)CCO

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=NN(C(=C2C3=CC=NC=C3)C4=CC=C(C=C4)Cl)CCO

InChI

InChI=1S/C25H30ClN5O3/c1-25(2,3)34-24(33)30-14-12-29(13-15-30)23-21(18-8-10-27-11-9-18)22(31(28-23)16-17-32)19-4-6-20(26)7-5-19/h4-11,32H,12-17H2,1-3H3