1-[2-[3-(4-chlorophenyl)-4-pyrimidin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]-4-methyl-2-oxidanyl-pentan-1-one

Systemtic Name: 1-[2-[3-(4-chlorophenyl)-4-pyrimidin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]-4-methyl-2-oxidanyl-pentan-1-one Openeye Name: 1-[2-[3-(4-chlorophenyl)-4-pyrimidin-4-yl-1H-pyrazol-5-yl]-1-piperidyl]-2-hydroxy-4-methyl-pentan-1-one CAS Name: 1-[2-[3-(4-chlorophenyl)-4-(4-pyrimidinyl)-1H-pyrazol-5-yl]-1-piperidinyl]-2-hydroxy-4-methyl-1-pentanone IUPAC Name: 1-[2-[3-(4-chlorophenyl)-4-pyrimidin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]-2-hydroxy-4-methylpentan-1-one Traditional Name: 1-[2-[3-(4-chlorophenyl)-4-(4-pyrimidyl)-1H-pyrazol-5-yl]piperidino]-2-hydroxy-4-methyl-pentan-1-one Formula: C24H28ClN5O2 MolecularWeight: 453.96442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N1CCCCC1C2=C(C(=NN2)C3=CC=C(C=C3)Cl)C4=NC=NC=C4)O

Isomeric SMILES

CC(C)CC(C(=O)N1CCCCC1C2=C(C(=NN2)C3=CC=C(C=C3)Cl)C4=NC=NC=C4)O

InChI

InChI=1S/C24H28ClN5O2/c1-15(2)13-20(31)24(32)30-12-4-3-5-19(30)23-21(18-10-11-26-14-27-18)22(28-29-23)16-6-8-17(25)9-7-16/h6-11,14-15,19-20,31H,3-5,12-13H2,1-2H3,(H,28,29)