4-[[2-(5-chloranyl-2-fluoranyl-phenyl)-5-methoxy-pyrimidin-4-yl]amino]-N-(3-pyrrolidin-1-ylpropyl)pyridine-3-carboxamide

Systemtic Name: 4-[[2-(5-chloranyl-2-fluoranyl-phenyl)-5-methoxy-pyrimidin-4-yl]amino]-N-(3-pyrrolidin-1-ylpropyl)pyridine-3-carboxamide Openeye Name: 4-[[2-(5-chloro-2-fluoro-phenyl)-5-methoxy-pyrimidin-4-yl]amino]-N-(3-pyrrolidin-1-ylpropyl)pyridine-3-carboxamide CAS Name: 4-[[2-(5-chloro-2-fluorophenyl)-5-methoxy-4-pyrimidinyl]amino]-N-[3-(1-pyrrolidinyl)propyl]-3-pyridinecarboxamide IUPAC Name: 4-[[2-(5-chloro-2-fluorophenyl)-5-methoxypyrimidin-4-yl]amino]-N-(3-pyrrolidin-1-ylpropyl)pyridine-3-carboxamide Traditional Name: 4-[[2-(5-chloro-2-fluoro-phenyl)-5-methoxy-pyrimidin-4-yl]amino]-N-(3-pyrrolidinopropyl)nicotinamide Formula: C24H26ClFN6O2 MolecularWeight: 484.953643

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CN=C(N=C1NC2=C(C=NC=C2)C(=O)NCCCN3CCCC3)C4=C(C=CC(=C4)Cl)F

Isomeric SMILES

COC1=CN=C(N=C1NC2=C(C=NC=C2)C(=O)NCCCN3CCCC3)C4=C(C=CC(=C4)Cl)F

InChI

InChI=1S/C24H26ClFN6O2/c1-34-21-15-29-22(17-13-16(25)5-6-19(17)26)31-23(21)30-20-7-9-27-14-18(20)24(33)28-8-4-12-32-10-2-3-11-32/h5-7,9,13-15H,2-4,8,10-12H2,1H3,(H,28,33)(H,27,29,30,31)