4-[[4-azanyl-5-(5-fluoranyl-2-methoxy-phenyl)carbonyl-pyrimidin-2-yl]amino]-N-cyclohexyl-piperidine-1-carboxamide

Systemtic Name: 4-[[4-azanyl-5-(5-fluoranyl-2-methoxy-phenyl)carbonyl-pyrimidin-2-yl]amino]-N-cyclohexyl-piperidine-1-carboxamide Openeye Name: 4-[[4-amino-5-(5-fluoro-2-methoxy-benzoyl)pyrimidin-2-yl]amino]-N-cyclohexyl-piperidine-1-carboxamide CAS Name: 4-[[4-amino-5-[(5-fluoro-2-methoxyphenyl)-oxomethyl]-2-pyrimidinyl]amino]-N-cyclohexyl-1-piperidinecarboxamide IUPAC Name: 4-[[4-amino-5-(5-fluoro-2-methoxybenzoyl)pyrimidin-2-yl]amino]-N-cyclohexylpiperidine-1-carboxamide Traditional Name: 4-[[4-amino-5-(5-fluoro-2-methoxy-benzoyl)pyrimidin-2-yl]amino]-N-cyclohexyl-piperidine-1-carboxamide Formula: C24H31FN6O3 MolecularWeight: 470.539743

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)F)C(=O)C2=CN=C(N=C2N)NC3CCN(CC3)C(=O)NC4CCCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)F)C(=O)C2=CN=C(N=C2N)NC3CCN(CC3)C(=O)NC4CCCCC4

InChI

InChI=1S/C24H31FN6O3/c1-34-20-8-7-15(25)13-18(20)21(32)19-14-27-23(30-22(19)26)28-17-9-11-31(12-10-17)24(33)29-16-5-3-2-4-6-16/h7-8,13-14,16-17H,2-6,9-12H2,1H3,(H,29,33)(H3,26,27,28,30)