N-(2-chlorophenyl)-2-(1-methyl-4-thiophen-2-ylcarbonyl-piperazin-1-ium-1-yl)ethanamide chloride

Systemtic Name: N-(2-chlorophenyl)-2-(1-methyl-4-thiophen-2-ylcarbonyl-piperazin-1-ium-1-yl)ethanamide chloride Openeye Name: N-(2-chlorophenyl)-2-[1-methyl-4-(thiophene-2-carbonyl)piperazin-1-ium-1-yl]acetamide chloride CAS Name: N-(2-chlorophenyl)-2-[1-methyl-4-[oxo(thiophen-2-yl)methyl]-1-piperazin-1-iumyl]acetamide chloride IUPAC Name: N-(2-chlorophenyl)-2-[1-methyl-4-(thiophene-2-carbonyl)piperazin-1-ium-1-yl]acetamide chloride Traditional Name: N-(2-chlorophenyl)-2-[1-methyl-4-(2-thenoyl)piperazin-1-ium-1-yl]acetamide chloride Formula: C18H21Cl2N3O2S MolecularWeight: 414.34924

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCN(CC1)C(=O)C2=CC=CS2)CC(=O)NC3=CC=CC=C3Cl.[Cl-]

Isomeric SMILES

C[N+]1(CCN(CC1)C(=O)C2=CC=CS2)CC(=O)NC3=CC=CC=C3Cl.[Cl-]

InChI

InChI=1S/C18H20ClN3O2S.ClH/c1-22(13-17(23)20-15-6-3-2-5-14(15)19)10-8-21(9-11-22)18(24)16-7-4-12-25-16;/h2-7,12H,8-11,13H2,1H3;1H