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

Systemtic Name: (2S)-2-(4-ethylpiperazin-4-ium-1-yl)-2-(4-fluorophenyl)ethanethioamide Openeye Name: (2S)-2-(4-ethylpiperazin-4-ium-1-yl)-2-(4-fluorophenyl)thioacetamide CAS Name: (2S)-2-(4-ethyl-1-piperazin-4-iumyl)-2-(4-fluorophenyl)ethanethioamide IUPAC Name: (2S)-2-(4-ethylpiperazin-4-ium-1-yl)-2-(4-fluorophenyl)ethanethioamide Traditional Name: (2S)-2-(4-ethylpiperazin-4-ium-1-yl)-2-(4-fluorophenyl)thioacetamide Formula: C14H21FN3S+ MolecularWeight: 282.400043

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(C2=CC=C(C=C2)F)C(=S)N

Isomeric SMILES

CC[NH+]1CCN(CC1)[C@@H](C2=CC=C(C=C2)F)C(=S)N

InChI

InChI=1S/C14H20FN3S/c1-2-17-7-9-18(10-8-17)13(14(16)19)11-3-5-12(15)6-4-11/h3-6,13H,2,7-10H2,1H3,(H2,16,19)/p+1/t13-/m0/s1