2-chloranyl-4-fluoranyl-N-[4-[(2-methyl-6-pyrazol-1-yl-pyrimidin-4-yl)amino]phenyl]benzamide

Systemtic Name: 2-chloranyl-4-fluoranyl-N-[4-[(2-methyl-6-pyrazol-1-yl-pyrimidin-4-yl)amino]phenyl]benzamide Openeye Name: 2-chloro-4-fluoro-N-[4-[(2-methyl-6-pyrazol-1-yl-pyrimidin-4-yl)amino]phenyl]benzamide CAS Name: 2-chloro-4-fluoro-N-[4-[[2-methyl-6-(1-pyrazolyl)-4-pyrimidinyl]amino]phenyl]benzamide IUPAC Name: 2-chloro-4-fluoro-N-[4-[(2-methyl-6-pyrazol-1-ylpyrimidin-4-yl)amino]phenyl]benzamide Traditional Name: 2-chloro-4-fluoro-N-[4-[(2-methyl-6-pyrazol-1-yl-pyrimidin-4-yl)amino]phenyl]benzamide Formula: C21H16ClFN6O MolecularWeight: 422.842743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)NC2=CC=C(C=C2)NC(=O)C3=C(C=C(C=C3)F)Cl)N4C=CC=N4

Isomeric SMILES

CC1=NC(=CC(=N1)NC2=CC=C(C=C2)NC(=O)C3=C(C=C(C=C3)F)Cl)N4C=CC=N4

InChI

InChI=1S/C21H16ClFN6O/c1-13-25-19(12-20(26-13)29-10-2-9-24-29)27-15-4-6-16(7-5-15)28-21(30)17-8-3-14(23)11-18(17)22/h2-12H,1H3,(H,28,30)(H,25,26,27)