5-chloranyl-N2-[2-fluoranyl-5-methyl-4-(4-piperidin-1-ylcyclohexyl)phenyl]-N4-(5-methyl-1H-pyrazol-3-yl)pyrimidine-2,4-diamine

Systemtic Name: 5-chloranyl-N2-[2-fluoranyl-5-methyl-4-(4-piperidin-1-ylcyclohexyl)phenyl]-N4-(5-methyl-1H-pyrazol-3-yl)pyrimidine-2,4-diamine Openeye Name: 5-chloro-N2-[2-fluoro-5-methyl-4-[4-(1-piperidyl)cyclohexyl]phenyl]-N4-(5-methyl-1H-pyrazol-3-yl)pyrimidine-2,4-diamine CAS Name: 5-chloro-N2-[2-fluoro-5-methyl-4-[4-(1-piperidinyl)cyclohexyl]phenyl]-N4-(5-methyl-1H-pyrazol-3-yl)pyrimidine-2,4-diamine IUPAC Name: 5-chloro-2-N-[2-fluoro-5-methyl-4-(4-piperidin-1-ylcyclohexyl)phenyl]-4-N-(5-methyl-1H-pyrazol-3-yl)pyrimidine-2,4-diamine Traditional Name: [5-chloro-2-[2-fluoro-5-methyl-4-(4-piperidinocyclohexyl)anilino]pyrimidin-4-yl]-(5-methyl-1H-pyrazol-3-yl)amine Formula: C26H33ClFN7 MolecularWeight: 498.038523

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C2CCC(CC2)N3CCCCC3)F)NC4=NC=C(C(=N4)NC5=NNC(=C5)C)Cl

Isomeric SMILES

CC1=CC(=C(C=C1C2CCC(CC2)N3CCCCC3)F)NC4=NC=C(C(=N4)NC5=NNC(=C5)C)Cl

InChI

InChI=1S/C26H33ClFN7/c1-16-12-23(30-26-29-15-21(27)25(32-26)31-24-13-17(2)33-34-24)22(28)14-20(16)18-6-8-19(9-7-18)35-10-4-3-5-11-35/h12-15,18-19H,3-11H2,1-2H3,(H3,29,30,31,32,33,34)