[4-[3-(4-chlorophenyl)-4-pyrimidin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]-(3-oxidanylcyclohexyl)methanone

Systemtic Name: [4-[3-(4-chlorophenyl)-4-pyrimidin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]-(3-oxidanylcyclohexyl)methanone Openeye Name: [4-[3-(4-chlorophenyl)-4-pyrimidin-4-yl-1H-pyrazol-5-yl]-1-piperidyl]-(3-hydroxycyclohexyl)methanone CAS Name: [4-[3-(4-chlorophenyl)-4-(4-pyrimidinyl)-1H-pyrazol-5-yl]-1-piperidinyl]-(3-hydroxycyclohexyl)methanone IUPAC Name: [4-[3-(4-chlorophenyl)-4-pyrimidin-4-yl-1H-pyrazol-5-yl]piperidin-1-yl]-(3-hydroxycyclohexyl)methanone Traditional Name: [4-[3-(4-chlorophenyl)-4-(4-pyrimidyl)-1H-pyrazol-5-yl]piperidino]-(3-hydroxycyclohexyl)methanone Formula: C25H28ClN5O2 MolecularWeight: 465.97512

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC(C1)O)C(=O)N2CCC(CC2)C3=C(C(=NN3)C4=CC=C(C=C4)Cl)C5=NC=NC=C5

Isomeric SMILES

C1CC(CC(C1)O)C(=O)N2CCC(CC2)C3=C(C(=NN3)C4=CC=C(C=C4)Cl)C5=NC=NC=C5

InChI

InChI=1S/C25H28ClN5O2/c26-19-6-4-16(5-7-19)23-22(21-8-11-27-15-28-21)24(30-29-23)17-9-12-31(13-10-17)25(33)18-2-1-3-20(32)14-18/h4-8,11,15,17-18,20,32H,1-3,9-10,12-14H2,(H,29,30)