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

Systemtic Name: 5-chloranyl-N2-[4-(1-cyclopropylpiperidin-4-yl)-2-fluoranyl-5-methyl-phenyl]-N4-(5-methyl-1H-pyrazol-3-yl)pyrimidine-2,4-diamine Openeye Name: 5-chloro-N2-[4-(1-cyclopropyl-4-piperidyl)-2-fluoro-5-methyl-phenyl]-N4-(5-methyl-1H-pyrazol-3-yl)pyrimidine-2,4-diamine CAS Name: 5-chloro-N2-[4-(1-cyclopropyl-4-piperidinyl)-2-fluoro-5-methylphenyl]-N4-(5-methyl-1H-pyrazol-3-yl)pyrimidine-2,4-diamine IUPAC Name: 5-chloro-2-N-[4-(1-cyclopropylpiperidin-4-yl)-2-fluoro-5-methylphenyl]-4-N-(5-methyl-1H-pyrazol-3-yl)pyrimidine-2,4-diamine Traditional Name: [5-chloro-2-[4-(1-cyclopropyl-4-piperidyl)-2-fluoro-5-methyl-anilino]pyrimidin-4-yl]-(5-methyl-1H-pyrazol-3-yl)amine Formula: C23H27ClFN7 MolecularWeight: 455.958783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C2CCN(CC2)C3CC3)F)NC4=NC=C(C(=N4)NC5=NNC(=C5)C)Cl

Isomeric SMILES

CC1=CC(=C(C=C1C2CCN(CC2)C3CC3)F)NC4=NC=C(C(=N4)NC5=NNC(=C5)C)Cl

InChI

InChI=1S/C23H27ClFN7/c1-13-9-20(19(25)11-17(13)15-5-7-32(8-6-15)16-3-4-16)27-23-26-12-18(24)22(29-23)28-21-10-14(2)30-31-21/h9-12,15-16H,3-8H2,1-2H3,(H3,26,27,28,29,30,31)