N-[3-[[4-(2-fluorophenyl)piperazin-1-ium-1-yl]methyl]-4,5-dimethyl-thiophen-2-yl]furan-2-carboxamide

Systemtic Name: N-[3-[[4-(2-fluorophenyl)piperazin-1-ium-1-yl]methyl]-4,5-dimethyl-thiophen-2-yl]furan-2-carboxamide Openeye Name: N-[3-[[4-(2-fluorophenyl)piperazin-1-ium-1-yl]methyl]-4,5-dimethyl-2-thienyl]furan-2-carboxamide CAS Name: N-[3-[[4-(2-fluorophenyl)-1-piperazin-1-iumyl]methyl]-4,5-dimethyl-2-thiophenyl]-2-furancarboxamide IUPAC Name: N-[3-[[4-(2-fluorophenyl)piperazin-1-ium-1-yl]methyl]-4,5-dimethylthiophen-2-yl]furan-2-carboxamide Traditional Name: N-[3-[[4-(2-fluorophenyl)piperazin-1-ium-1-yl]methyl]-4,5-dimethyl-2-thienyl]-2-furamide Formula: C22H25FN3O2S+ MolecularWeight: 414.516203

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C[NH+]2CCN(CC2)C3=CC=CC=C3F)NC(=O)C4=CC=CO4)C

Isomeric SMILES

CC1=C(SC(=C1C[NH+]2CCN(CC2)C3=CC=CC=C3F)NC(=O)C4=CC=CO4)C

InChI

InChI=1S/C22H24FN3O2S/c1-15-16(2)29-22(24-21(27)20-8-5-13-28-20)17(15)14-25-9-11-26(12-10-25)19-7-4-3-6-18(19)23/h3-8,13H,9-12,14H2,1-2H3,(H,24,27)/p+1