5-[(3-fluoranyl-5-pyrrolidin-1-yl-phenyl)carbonylamino]-2-methyl-N-[6-(oxan-4-ylamino)pyridin-3-yl]pyridine-3-carboxamide

Systemtic Name: 5-[(3-fluoranyl-5-pyrrolidin-1-yl-phenyl)carbonylamino]-2-methyl-N-[6-(oxan-4-ylamino)pyridin-3-yl]pyridine-3-carboxamide Openeye Name: 5-[(3-fluoro-5-pyrrolidin-1-yl-benzoyl)amino]-2-methyl-N-[6-(tetrahydropyran-4-ylamino)-3-pyridyl]pyridine-3-carboxamide CAS Name: 5-[[[3-fluoro-5-(1-pyrrolidinyl)phenyl]-oxomethyl]amino]-2-methyl-N-[6-(4-oxanylamino)-3-pyridinyl]-3-pyridinecarboxamide IUPAC Name: 5-[(3-fluoro-5-pyrrolidin-1-ylbenzoyl)amino]-2-methyl-N-[6-(oxan-4-ylamino)pyridin-3-yl]pyridine-3-carboxamide Traditional Name: 5-[(3-fluoro-5-pyrrolidino-benzoyl)amino]-2-methyl-N-[6-(tetrahydropyran-4-ylamino)-3-pyridyl]nicotinamide Formula: C28H31FN6O3 MolecularWeight: 518.582543

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1C(=O)NC2=CN=C(C=C2)NC3CCOCC3)NC(=O)C4=CC(=CC(=C4)F)N5CCCC5

Isomeric SMILES

CC1=NC=C(C=C1C(=O)NC2=CN=C(C=C2)NC3CCOCC3)NC(=O)C4=CC(=CC(=C4)F)N5CCCC5

InChI

InChI=1S/C28H31FN6O3/c1-18-25(28(37)33-22-4-5-26(31-16-22)32-21-6-10-38-11-7-21)15-23(17-30-18)34-27(36)19-12-20(29)14-24(13-19)35-8-2-3-9-35/h4-5,12-17,21H,2-3,6-11H2,1H3,(H,31,32)(H,33,37)(H,34,36)