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

Systemtic Name: 1-[4-[[4-azanyl-5-(5-fluoranyl-2-methoxy-phenyl)carbonyl-pyrimidin-2-yl]amino]piperidin-1-yl]-2-morpholin-4-yl-ethanone Openeye Name: 1-[4-[[4-amino-5-(5-fluoro-2-methoxy-benzoyl)pyrimidin-2-yl]amino]-1-piperidyl]-2-morpholino-ethanone CAS Name: 1-[4-[[4-amino-5-[(5-fluoro-2-methoxyphenyl)-oxomethyl]-2-pyrimidinyl]amino]-1-piperidinyl]-2-(4-morpholinyl)ethanone IUPAC Name: 1-[4-[[4-amino-5-(5-fluoro-2-methoxybenzoyl)pyrimidin-2-yl]amino]piperidin-1-yl]-2-morpholin-4-ylethanone Traditional Name: 1-[4-[[4-amino-5-(5-fluoro-2-methoxy-benzoyl)pyrimidin-2-yl]amino]piperidino]-2-morpholino-ethanone Formula: C23H29FN6O4 MolecularWeight: 472.512563

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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)C(=O)CN4CCOCC4

Isomeric SMILES

COC1=C(C=C(C=C1)F)C(=O)C2=CN=C(N=C2N)NC3CCN(CC3)C(=O)CN4CCOCC4

InChI

InChI=1S/C23H29FN6O4/c1-33-19-3-2-15(24)12-17(19)21(32)18-13-26-23(28-22(18)25)27-16-4-6-30(7-5-16)20(31)14-29-8-10-34-11-9-29/h2-3,12-13,16H,4-11,14H2,1H3,(H3,25,26,27,28)