2-[4-[3-[(4-fluorophenyl)-pyridin-4-yl-amino]propyl]piperazin-1-yl]pyridine-3-carboxamide

Systemtic Name: 2-[4-[3-[(4-fluorophenyl)-pyridin-4-yl-amino]propyl]piperazin-1-yl]pyridine-3-carboxamide Openeye Name: 2-[4-[3-[4-fluoro-N-(4-pyridyl)anilino]propyl]piperazin-1-yl]pyridine-3-carboxamide CAS Name: 2-[4-[3-(4-fluoro-N-pyridin-4-ylanilino)propyl]-1-piperazinyl]-3-pyridinecarboxamide IUPAC Name: 2-[4-[3-(4-fluoro-N-pyridin-4-ylanilino)propyl]piperazin-1-yl]pyridine-3-carboxamide Traditional Name: 2-[4-[3-[4-fluoro-N-(4-pyridyl)anilino]propyl]piperazino]nicotinamide Formula: C24H27FN6O MolecularWeight: 434.509183

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCN(C2=CC=C(C=C2)F)C3=CC=NC=C3)C4=C(C=CC=N4)C(=O)N

Isomeric SMILES

C1CN(CCN1CCCN(C2=CC=C(C=C2)F)C3=CC=NC=C3)C4=C(C=CC=N4)C(=O)N

InChI

InChI=1S/C24H27FN6O/c25-19-4-6-20(7-5-19)31(21-8-11-27-12-9-21)14-2-13-29-15-17-30(18-16-29)24-22(23(26)32)3-1-10-28-24/h1,3-12H,2,13-18H2,(H2,26,32)