methyl 2-[4-[[4-azanyl-5-(5-fluoranyl-2-methoxy-phenyl)carbonyl-pyrimidin-2-yl]amino]piperidin-1-yl]ethanoate

Systemtic Name: methyl 2-[4-[[4-azanyl-5-(5-fluoranyl-2-methoxy-phenyl)carbonyl-pyrimidin-2-yl]amino]piperidin-1-yl]ethanoate Openeye Name: methyl 2-[4-[[4-amino-5-(5-fluoro-2-methoxy-benzoyl)pyrimidin-2-yl]amino]-1-piperidyl]acetate CAS Name: 2-[4-[[4-amino-5-[(5-fluoro-2-methoxyphenyl)-oxomethyl]-2-pyrimidinyl]amino]-1-piperidinyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-[[4-amino-5-(5-fluoro-2-methoxybenzoyl)pyrimidin-2-yl]amino]piperidin-1-yl]acetate Traditional Name: 2-[4-[[4-amino-5-(5-fluoro-2-methoxy-benzoyl)pyrimidin-2-yl]amino]piperidino]acetic acid methyl ester Formula: C20H24FN5O4 MolecularWeight: 417.434063

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)F)C(=O)C2=CN=C(N=C2N)NC3CCN(CC3)CC(=O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)F)C(=O)C2=CN=C(N=C2N)NC3CCN(CC3)CC(=O)OC

InChI

InChI=1S/C20H24FN5O4/c1-29-16-4-3-12(21)9-14(16)18(28)15-10-23-20(25-19(15)22)24-13-5-7-26(8-6-13)11-17(27)30-2/h3-4,9-10,13H,5-8,11H2,1-2H3,(H3,22,23,24,25)