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

Systemtic Name: 5-chloranyl-N2-[2-fluoranyl-5-methyl-4-(3-methylsulfonylphenyl)phenyl]-N4-(5-methyl-1H-pyrazol-3-yl)pyrimidine-2,4-diamine Openeye Name: 5-chloro-N2-[2-fluoro-5-methyl-4-(3-methylsulfonylphenyl)phenyl]-N4-(5-methyl-1H-pyrazol-3-yl)pyrimidine-2,4-diamine CAS Name: 5-chloro-N2-[2-fluoro-5-methyl-4-(3-methylsulfonylphenyl)phenyl]-N4-(5-methyl-1H-pyrazol-3-yl)pyrimidine-2,4-diamine IUPAC Name: 5-chloro-2-N-[2-fluoro-5-methyl-4-(3-methylsulfonylphenyl)phenyl]-4-N-(5-methyl-1H-pyrazol-3-yl)pyrimidine-2,4-diamine Traditional Name: [5-chloro-2-[2-fluoro-4-(3-mesylphenyl)-5-methyl-anilino]pyrimidin-4-yl]-(5-methyl-1H-pyrazol-3-yl)amine Formula: C22H20ClFN6O2S MolecularWeight: 486.949603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C2=CC(=CC=C2)S(=O)(=O)C)F)NC3=NC=C(C(=N3)NC4=NNC(=C4)C)Cl

Isomeric SMILES

CC1=CC(=C(C=C1C2=CC(=CC=C2)S(=O)(=O)C)F)NC3=NC=C(C(=N3)NC4=NNC(=C4)C)Cl

InChI

InChI=1S/C22H20ClFN6O2S/c1-12-7-19(18(24)10-16(12)14-5-4-6-15(9-14)33(3,31)32)26-22-25-11-17(23)21(28-22)27-20-8-13(2)29-30-20/h4-11H,1-3H3,(H3,25,26,27,28,29,30)