N-[(5-chloranylthiophen-2-yl)methyl]-2-[4-(4-ethanoylphenyl)piperazin-1-ium-1-yl]-N-ethyl-ethanamide

Systemtic Name: N-[(5-chloranylthiophen-2-yl)methyl]-2-[4-(4-ethanoylphenyl)piperazin-1-ium-1-yl]-N-ethyl-ethanamide Openeye Name: 2-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]-N-[(5-chloro-2-thienyl)methyl]-N-ethyl-acetamide CAS Name: 2-[4-(4-acetylphenyl)-1-piperazin-1-iumyl]-N-[(5-chloro-2-thiophenyl)methyl]-N-ethylacetamide IUPAC Name: 2-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]-N-[(5-chlorothiophen-2-yl)methyl]-N-ethylacetamide Traditional Name: 2-[4-(4-acetylphenyl)piperazin-1-ium-1-yl]-N-[(5-chloro-2-thienyl)methyl]-N-ethyl-acetamide Formula: C21H27ClN3O2S+ MolecularWeight: 420.97598

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=C(S1)Cl)C(=O)C[NH+]2CCN(CC2)C3=CC=C(C=C3)C(=O)C

Isomeric SMILES

CCN(CC1=CC=C(S1)Cl)C(=O)C[NH+]2CCN(CC2)C3=CC=C(C=C3)C(=O)C

InChI

InChI=1S/C21H26ClN3O2S/c1-3-24(14-19-8-9-20(22)28-19)21(27)15-23-10-12-25(13-11-23)18-6-4-17(5-7-18)16(2)26/h4-9H,3,10-15H2,1-2H3/p+1