6-chloranyl-5-fluoranyl-N-(4-propan-2-ylphenyl)-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide

Systemtic Name: 6-chloranyl-5-fluoranyl-N-(4-propan-2-ylphenyl)-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide Openeye Name: 6-chloro-5-fluoro-N-(4-isopropylphenyl)-2-(4-pyridylmethylamino)pyridine-3-carboxamide CAS Name: 6-chloro-5-fluoro-N-(4-propan-2-ylphenyl)-2-(pyridin-4-ylmethylamino)-3-pyridinecarboxamide IUPAC Name: 6-chloro-5-fluoro-N-(4-propan-2-ylphenyl)-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide Traditional Name: 6-chloro-5-fluoro-N-p-cumenyl-2-(4-pyridylmethylamino)nicotinamide Formula: C21H20ClFN4O MolecularWeight: 398.861103

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=O)C2=CC(=C(N=C2NCC3=CC=NC=C3)Cl)F

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=O)C2=CC(=C(N=C2NCC3=CC=NC=C3)Cl)F

InChI

InChI=1S/C21H20ClFN4O/c1-13(2)15-3-5-16(6-4-15)26-21(28)17-11-18(23)19(22)27-20(17)25-12-14-7-9-24-10-8-14/h3-11,13H,12H2,1-2H3,(H,25,27)(H,26,28)