N-[(Z)-1-[4-(4-ethylpiperazin-4-ium-1-yl)-3-fluoranyl-phenyl]ethylideneamino]pyridine-4-carboxamide

Systemtic Name: N-[(Z)-1-[4-(4-ethylpiperazin-4-ium-1-yl)-3-fluoranyl-phenyl]ethylideneamino]pyridine-4-carboxamide Openeye Name: N-[(Z)-1-[4-(4-ethylpiperazin-4-ium-1-yl)-3-fluoro-phenyl]ethylideneamino]pyridine-4-carboxamide CAS Name: N-[(Z)-1-[4-(4-ethyl-1-piperazin-4-iumyl)-3-fluorophenyl]ethylideneamino]-4-pyridinecarboxamide IUPAC Name: N-[(Z)-1-[4-(4-ethylpiperazin-4-ium-1-yl)-3-fluorophenyl]ethylideneamino]pyridine-4-carboxamide Traditional Name: N-[(Z)-1-[4-(4-ethylpiperazin-4-ium-1-yl)-3-fluoro-phenyl]ethylideneamino]isonicotinamide Formula: C20H25FN5O+ MolecularWeight: 370.443803

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)C(=NNC(=O)C3=CC=NC=C3)C)F

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)/C(=N\NC(=O)C3=CC=NC=C3)/C)F

InChI

InChI=1S/C20H24FN5O/c1-3-25-10-12-26(13-11-25)19-5-4-17(14-18(19)21)15(2)23-24-20(27)16-6-8-22-9-7-16/h4-9,14H,3,10-13H2,1-2H3,(H,24,27)/p+1/b23-15-