ethyl 4-[[5-fluoranyl-4-[2-methyl-3-(oxan-4-yl)imidazol-4-yl]pyrimidin-2-yl]amino]benzoate

Systemtic Name: ethyl 4-[[5-fluoranyl-4-[2-methyl-3-(oxan-4-yl)imidazol-4-yl]pyrimidin-2-yl]amino]benzoate Openeye Name: ethyl 4-[[5-fluoro-4-(2-methyl-3-tetrahydropyran-4-yl-imidazol-4-yl)pyrimidin-2-yl]amino]benzoate CAS Name: 4-[[5-fluoro-4-[2-methyl-3-(4-oxanyl)-4-imidazolyl]-2-pyrimidinyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[5-fluoro-4-[2-methyl-3-(oxan-4-yl)imidazol-4-yl]pyrimidin-2-yl]amino]benzoate Traditional Name: 4-[[5-fluoro-4-(2-methyl-3-tetrahydropyran-4-yl-imidazol-4-yl)pyrimidin-2-yl]amino]benzoic acid ethyl ester Formula: C22H24FN5O3 MolecularWeight: 425.456063

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC2=NC=C(C(=N2)C3=CN=C(N3C4CCOCC4)C)F

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC2=NC=C(C(=N2)C3=CN=C(N3C4CCOCC4)C)F

InChI

InChI=1S/C22H24FN5O3/c1-3-31-21(29)15-4-6-16(7-5-15)26-22-25-12-18(23)20(27-22)19-13-24-14(2)28(19)17-8-10-30-11-9-17/h4-7,12-13,17H,3,8-11H2,1-2H3,(H,25,26,27)