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

Systemtic Name: 4-[[2-(5-chloranyl-2-fluoranyl-phenyl)-5-pyrrolidin-1-yl-pyrimidin-4-yl]amino]-N-(2-hydroxyethyl)pyridine-3-carboxamide Openeye Name: 4-[[2-(5-chloro-2-fluoro-phenyl)-5-pyrrolidin-1-yl-pyrimidin-4-yl]amino]-N-(2-hydroxyethyl)pyridine-3-carboxamide CAS Name: 4-[[2-(5-chloro-2-fluorophenyl)-5-(1-pyrrolidinyl)-4-pyrimidinyl]amino]-N-(2-hydroxyethyl)-3-pyridinecarboxamide IUPAC Name: 4-[[2-(5-chloro-2-fluorophenyl)-5-pyrrolidin-1-ylpyrimidin-4-yl]amino]-N-(2-hydroxyethyl)pyridine-3-carboxamide Traditional Name: 4-[[2-(5-chloro-2-fluoro-phenyl)-5-pyrrolidino-pyrimidin-4-yl]amino]-N-(2-hydroxyethyl)nicotinamide Formula: C22H22ClFN6O2 MolecularWeight: 456.900483

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CN=C(N=C2NC3=C(C=NC=C3)C(=O)NCCO)C4=C(C=CC(=C4)Cl)F

Isomeric SMILES

C1CCN(C1)C2=CN=C(N=C2NC3=C(C=NC=C3)C(=O)NCCO)C4=C(C=CC(=C4)Cl)F

InChI

InChI=1S/C22H22ClFN6O2/c23-14-3-4-17(24)15(11-14)20-27-13-19(30-8-1-2-9-30)21(29-20)28-18-5-6-25-12-16(18)22(32)26-7-10-31/h3-6,11-13,31H,1-2,7-10H2,(H,26,32)(H,25,27,28,29)