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

Systemtic Name: 5-chloranyl-N2-[2,5-dimethyl-4-(4-piperidin-1-ylcyclohexyl)phenyl]-N4-(5-methyl-1H-pyrazol-3-yl)pyrimidine-2,4-diamine Openeye Name: 5-chloro-N2-[2,5-dimethyl-4-[4-(1-piperidyl)cyclohexyl]phenyl]-N4-(5-methyl-1H-pyrazol-3-yl)pyrimidine-2,4-diamine CAS Name: 5-chloro-N2-[2,5-dimethyl-4-[4-(1-piperidinyl)cyclohexyl]phenyl]-N4-(5-methyl-1H-pyrazol-3-yl)pyrimidine-2,4-diamine IUPAC Name: 5-chloro-2-N-[2,5-dimethyl-4-(4-piperidin-1-ylcyclohexyl)phenyl]-4-N-(5-methyl-1H-pyrazol-3-yl)pyrimidine-2,4-diamine Traditional Name: [5-chloro-2-[2,5-dimethyl-4-(4-piperidinocyclohexyl)anilino]pyrimidin-4-yl]-(5-methyl-1H-pyrazol-3-yl)amine Formula: C27H36ClN7 MolecularWeight: 494.07464

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H36ClN7/c1-17-14-24(30-27-29-16-23(28)26(32-27)31-25-15-19(3)33-34-25)18(2)13-22(17)20-7-9-21(10-8-20)35-11-5-4-6-12-35/h13-16,20-21H,4-12H2,1-3H3,(H3,29,30,31,32,33,34)