1-(5-chloranylthiophen-2-yl)-2-(4-ethylpiperazine-1,4-diium-1-yl)ethanone

Systemtic Name: 1-(5-chloranylthiophen-2-yl)-2-(4-ethylpiperazine-1,4-diium-1-yl)ethanone Openeye Name: 1-(5-chloro-2-thienyl)-2-(4-ethylpiperazine-1,4-diium-1-yl)ethanone CAS Name: 1-(5-chloro-2-thiophenyl)-2-(4-ethyl-1-piperazine-1,4-diiumyl)ethanone IUPAC Name: 1-(5-chlorothiophen-2-yl)-2-(4-ethylpiperazine-1,4-diium-1-yl)ethanone Traditional Name: 1-(5-chloro-2-thienyl)-2-(4-ethylpiperazine-1,4-diium-1-yl)ethanone Formula: C12H19ClN2OS+2 MolecularWeight: 274.81006

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CC[NH+](CC1)CC(=O)C2=CC=C(S2)Cl

Isomeric SMILES

CC[NH+]1CC[NH+](CC1)CC(=O)C2=CC=C(S2)Cl

InChI

InChI=1S/C12H17ClN2OS/c1-2-14-5-7-15(8-6-14)9-10(16)11-3-4-12(13)17-11/h3-4H,2,5-9H2,1H3/p+2