3-(4-fluorophenyl)-N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]imidazole-4-carboxamide

Systemtic Name: 3-(4-fluorophenyl)-N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]imidazole-4-carboxamide Openeye Name: 3-(4-fluorophenyl)-N-[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]imidazole-4-carboxamide CAS Name: 3-(4-fluorophenyl)-N-[6-(4-methyl-1-piperazin-4-iumyl)-3-pyridinyl]-4-imidazolecarboxamide IUPAC Name: 3-(4-fluorophenyl)-N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]imidazole-4-carboxamide Traditional Name: 3-(4-fluorophenyl)-N-[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]imidazole-4-carboxamide Formula: C20H22FN6O+ MolecularWeight: 381.426683

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=NC=C(C=C2)NC(=O)C3=CN=CN3C4=CC=C(C=C4)F

Isomeric SMILES

C[NH+]1CCN(CC1)C2=NC=C(C=C2)NC(=O)C3=CN=CN3C4=CC=C(C=C4)F

InChI

InChI=1S/C20H21FN6O/c1-25-8-10-26(11-9-25)19-7-4-16(12-23-19)24-20(28)18-13-22-14-27(18)17-5-2-15(21)3-6-17/h2-7,12-14H,8-11H2,1H3,(H,24,28)/p+1