N-[6-chloranyl-5-fluoranyl-2-(pyridin-4-ylmethylamino)pyridin-3-yl]-4-propan-2-yl-benzamide

Systemtic Name: N-[6-chloranyl-5-fluoranyl-2-(pyridin-4-ylmethylamino)pyridin-3-yl]-4-propan-2-yl-benzamide Openeye Name: N-[6-chloro-5-fluoro-2-(4-pyridylmethylamino)-3-pyridyl]-4-isopropyl-benzamide CAS Name: N-[6-chloro-5-fluoro-2-(pyridin-4-ylmethylamino)-3-pyridinyl]-4-propan-2-ylbenzamide IUPAC Name: N-[6-chloro-5-fluoro-2-(pyridin-4-ylmethylamino)pyridin-3-yl]-4-propan-2-ylbenzamide Traditional Name: N-[6-chloro-5-fluoro-2-(4-pyridylmethylamino)-3-pyridyl]-4-isopropyl-benzamide Formula: C21H20ClFN4O MolecularWeight: 398.861103

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(=O)NC2=CC(=C(N=C2NCC3=CC=NC=C3)Cl)F

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(=O)NC2=CC(=C(N=C2NCC3=CC=NC=C3)Cl)F

InChI

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