3-(4-fluorophenyl)-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-methylsulfanyl-imidazole-4-carboxamide

Systemtic Name: 3-(4-fluorophenyl)-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-methylsulfanyl-imidazole-4-carboxamide Openeye Name: 3-(4-fluorophenyl)-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-methylsulfanyl-imidazole-4-carboxamide CAS Name: 3-(4-fluorophenyl)-N-[2-(4-methyl-1-piperazin-4-iumyl)phenyl]-2-(methylthio)-4-imidazolecarboxamide IUPAC Name: 3-(4-fluorophenyl)-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-methylsulfanylimidazole-4-carboxamide Traditional Name: 3-(4-fluorophenyl)-N-[2-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-(methylthio)imidazole-4-carboxamide Formula: C22H25FN5OS+ MolecularWeight: 426.530203

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=CC=CC=C2NC(=O)C3=CN=C(N3C4=CC=C(C=C4)F)SC

Isomeric SMILES

C[NH+]1CCN(CC1)C2=CC=CC=C2NC(=O)C3=CN=C(N3C4=CC=C(C=C4)F)SC

InChI

InChI=1S/C22H24FN5OS/c1-26-11-13-27(14-12-26)19-6-4-3-5-18(19)25-21(29)20-15-24-22(30-2)28(20)17-9-7-16(23)8-10-17/h3-10,15H,11-14H2,1-2H3,(H,25,29)/p+1