4-[[4-[5-methyl-3-[3-(4-methylpiperazin-1-yl)propylamino]-1-phenyl-pyrazol-4-yl]pyrimidin-2-yl]amino]cyclohexan-1-ol

Systemtic Name: 4-[[4-[5-methyl-3-[3-(4-methylpiperazin-1-yl)propylamino]-1-phenyl-pyrazol-4-yl]pyrimidin-2-yl]amino]cyclohexan-1-ol Openeye Name: 4-[[4-[5-methyl-3-[3-(4-methylpiperazin-1-yl)propylamino]-1-phenyl-pyrazol-4-yl]pyrimidin-2-yl]amino]cyclohexanol CAS Name: 4-[[4-[5-methyl-3-[3-(4-methyl-1-piperazinyl)propylamino]-1-phenyl-4-pyrazolyl]-2-pyrimidinyl]amino]-1-cyclohexanol IUPAC Name: 4-[[4-[5-methyl-3-[3-(4-methylpiperazin-1-yl)propylamino]-1-phenylpyrazol-4-yl]pyrimidin-2-yl]amino]cyclohexan-1-ol Traditional Name: 4-[[4-[5-methyl-3-[3-(4-methylpiperazino)propylamino]-1-phenyl-pyrazol-4-yl]pyrimidin-2-yl]amino]cyclohexanol Formula: C28H40N8O MolecularWeight: 504.6702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)NCCCN3CCN(CC3)C)C4=NC(=NC=C4)NC5CCC(CC5)O

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)NCCCN3CCN(CC3)C)C4=NC(=NC=C4)NC5CCC(CC5)O

InChI

InChI=1S/C28H40N8O/c1-21-26(25-13-15-30-28(32-25)31-22-9-11-24(37)12-10-22)27(33-36(21)23-7-4-3-5-8-23)29-14-6-16-35-19-17-34(2)18-20-35/h3-5,7-8,13,15,22,24,37H,6,9-12,14,16-20H2,1-2H3,(H,29,33)(H,30,31,32)