4-[3-(4-chlorophenyl)-5-[4-(4-ethylpiperazin-1-yl)cyclohexyl]-1H-pyrazol-4-yl]pyrimidine

Systemtic Name: 4-[3-(4-chlorophenyl)-5-[4-(4-ethylpiperazin-1-yl)cyclohexyl]-1H-pyrazol-4-yl]pyrimidine Openeye Name: 4-[3-(4-chlorophenyl)-5-[4-(4-ethylpiperazin-1-yl)cyclohexyl]-1H-pyrazol-4-yl]pyrimidine CAS Name: 4-[3-(4-chlorophenyl)-5-[4-(4-ethyl-1-piperazinyl)cyclohexyl]-1H-pyrazol-4-yl]pyrimidine IUPAC Name: 4-[3-(4-chlorophenyl)-5-[4-(4-ethylpiperazin-1-yl)cyclohexyl]-1H-pyrazol-4-yl]pyrimidine Traditional Name: 4-[3-(4-chlorophenyl)-5-[4-(4-ethylpiperazino)cyclohexyl]-1H-pyrazol-4-yl]pyrimidine Formula: C25H31ClN6 MolecularWeight: 451.00684

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2CCC(CC2)C3=C(C(=NN3)C4=CC=C(C=C4)Cl)C5=NC=NC=C5

Isomeric SMILES

CCN1CCN(CC1)C2CCC(CC2)C3=C(C(=NN3)C4=CC=C(C=C4)Cl)C5=NC=NC=C5

InChI

InChI=1S/C25H31ClN6/c1-2-31-13-15-32(16-14-31)21-9-5-19(6-10-21)25-23(22-11-12-27-17-28-22)24(29-30-25)18-3-7-20(26)8-4-18/h3-4,7-8,11-12,17,19,21H,2,5-6,9-10,13-16H2,1H3,(H,29,30)