2-[(2-fluorophenyl)amino]-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]pyridine-3-carboxamide

Systemtic Name: 2-[(2-fluorophenyl)amino]-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]pyridine-3-carboxamide Openeye Name: 2-(2-fluoroanilino)-N-[6-(3-oxopiperazin-1-yl)-3-pyridyl]pyridine-3-carboxamide CAS Name: 2-(2-fluoroanilino)-N-[6-(3-oxo-1-piperazinyl)-3-pyridinyl]-3-pyridinecarboxamide IUPAC Name: 2-(2-fluoroanilino)-N-[6-(3-oxopiperazin-1-yl)pyridin-3-yl]pyridine-3-carboxamide Traditional Name: 2-(2-fluoroanilino)-N-[6-(3-ketopiperazino)-3-pyridyl]nicotinamide Formula: C21H19FN6O2 MolecularWeight: 406.412963

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)C2=NC=C(C=C2)NC(=O)C3=C(N=CC=C3)NC4=CC=CC=C4F

Isomeric SMILES

C1CN(CC(=O)N1)C2=NC=C(C=C2)NC(=O)C3=C(N=CC=C3)NC4=CC=CC=C4F

InChI

InChI=1S/C21H19FN6O2/c22-16-5-1-2-6-17(16)27-20-15(4-3-9-24-20)21(30)26-14-7-8-18(25-12-14)28-11-10-23-19(29)13-28/h1-9,12H,10-11,13H2,(H,23,29)(H,24,27)(H,26,30)