4-[3-(4-chlorophenyl)-5-(4-piperidin-1-ylcyclohexyl)-1H-pyrazol-4-yl]pyrimidine

Systemtic Name: 4-[3-(4-chlorophenyl)-5-(4-piperidin-1-ylcyclohexyl)-1H-pyrazol-4-yl]pyrimidine Openeye Name: 4-[3-(4-chlorophenyl)-5-[4-(1-piperidyl)cyclohexyl]-1H-pyrazol-4-yl]pyrimidine CAS Name: 4-[3-(4-chlorophenyl)-5-[4-(1-piperidinyl)cyclohexyl]-1H-pyrazol-4-yl]pyrimidine IUPAC Name: 4-[3-(4-chlorophenyl)-5-(4-piperidin-1-ylcyclohexyl)-1H-pyrazol-4-yl]pyrimidine Traditional Name: 4-[3-(4-chlorophenyl)-5-(4-piperidinocyclohexyl)-1H-pyrazol-4-yl]pyrimidine Formula: C24H28ClN5 MolecularWeight: 421.96562

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2CCC(CC2)C3=C(C(=NN3)C4=CC=C(C=C4)Cl)C5=NC=NC=C5

Isomeric SMILES

C1CCN(CC1)C2CCC(CC2)C3=C(C(=NN3)C4=CC=C(C=C4)Cl)C5=NC=NC=C5

InChI

InChI=1S/C24H28ClN5/c25-19-8-4-17(5-9-19)23-22(21-12-13-26-16-27-21)24(29-28-23)18-6-10-20(11-7-18)30-14-2-1-3-15-30/h4-5,8-9,12-13,16,18,20H,1-3,6-7,10-11,14-15H2,(H,28,29)