(2S)-2-(4-ethanoylpiperazin-1-ium-1-yl)-2-(4-fluorophenyl)ethanethioamide

Systemtic Name: (2S)-2-(4-ethanoylpiperazin-1-ium-1-yl)-2-(4-fluorophenyl)ethanethioamide Openeye Name: (2S)-2-(4-acetylpiperazin-1-ium-1-yl)-2-(4-fluorophenyl)thioacetamide CAS Name: (2S)-2-(4-acetyl-1-piperazin-1-iumyl)-2-(4-fluorophenyl)ethanethioamide IUPAC Name: (2S)-2-(4-acetylpiperazin-1-ium-1-yl)-2-(4-fluorophenyl)ethanethioamide Traditional Name: (2S)-2-(4-acetylpiperazin-1-ium-1-yl)-2-(4-fluorophenyl)thioacetamide Formula: C14H19FN3OS+ MolecularWeight: 296.383563

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC[NH+](CC1)C(C2=CC=C(C=C2)F)C(=S)N

Isomeric SMILES

CC(=O)N1CC[NH+](CC1)[C@@H](C2=CC=C(C=C2)F)C(=S)N

InChI

InChI=1S/C14H18FN3OS/c1-10(19)17-6-8-18(9-7-17)13(14(16)20)11-2-4-12(15)5-3-11/h2-5,13H,6-9H2,1H3,(H2,16,20)/p+1/t13-/m0/s1