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

Systemtic Name: (2S)-2-(2-chlorophenyl)-2-(4-ethylpiperazin-4-ium-1-yl)ethanethioamide Openeye Name: (2S)-2-(2-chlorophenyl)-2-(4-ethylpiperazin-4-ium-1-yl)thioacetamide CAS Name: (2S)-2-(2-chlorophenyl)-2-(4-ethyl-1-piperazin-4-iumyl)ethanethioamide IUPAC Name: (2S)-2-(2-chlorophenyl)-2-(4-ethylpiperazin-4-ium-1-yl)ethanethioamide Traditional Name: (2S)-2-(2-chlorophenyl)-2-(4-ethylpiperazin-4-ium-1-yl)thioacetamide Formula: C14H21ClN3S+ MolecularWeight: 298.85464

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(C2=CC=CC=C2Cl)C(=S)N

Isomeric SMILES

CC[NH+]1CCN(CC1)[C@@H](C2=CC=CC=C2Cl)C(=S)N

InChI

InChI=1S/C14H20ClN3S/c1-2-17-7-9-18(10-8-17)13(14(16)19)11-5-3-4-6-12(11)15/h3-6,13H,2,7-10H2,1H3,(H2,16,19)/p+1/t13-/m0/s1