2-chloranyl-6-[[5-[(3-fluoranyl-5-morpholin-4-yl-phenyl)carbonylamino]-2-methyl-phenyl]amino]pyrimidine-4-carboxamide

Systemtic Name: 2-chloranyl-6-[[5-[(3-fluoranyl-5-morpholin-4-yl-phenyl)carbonylamino]-2-methyl-phenyl]amino]pyrimidine-4-carboxamide Openeye Name: 2-chloro-6-[5-[(3-fluoro-5-morpholino-benzoyl)amino]-2-methyl-anilino]pyrimidine-4-carboxamide CAS Name: 2-chloro-6-[5-[[[3-fluoro-5-(4-morpholinyl)phenyl]-oxomethyl]amino]-2-methylanilino]-4-pyrimidinecarboxamide IUPAC Name: 2-chloro-6-[5-[(3-fluoro-5-morpholin-4-ylbenzoyl)amino]-2-methylanilino]pyrimidine-4-carboxamide Traditional Name: 2-chloro-6-[5-[(3-fluoro-5-morpholino-benzoyl)amino]-2-methyl-anilino]pyrimidine-4-carboxamide Formula: C23H22ClFN6O3 MolecularWeight: 484.910583

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC(=C2)F)N3CCOCC3)NC4=NC(=NC(=C4)C(=O)N)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC(=CC(=C2)F)N3CCOCC3)NC4=NC(=NC(=C4)C(=O)N)Cl

InChI

InChI=1S/C23H22ClFN6O3/c1-13-2-3-16(11-18(13)28-20-12-19(21(26)32)29-23(24)30-20)27-22(33)14-8-15(25)10-17(9-14)31-4-6-34-7-5-31/h2-3,8-12H,4-7H2,1H3,(H2,26,32)(H,27,33)(H,28,29,30)