N-phenyl-2-[4-(2-thiophen-2-ylethanoyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-phenyl-2-[4-(2-thiophen-2-ylethanoyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-phenyl-2-[4-[2-(2-thienyl)acetyl]piperazin-1-ium-1-yl]acetamide CAS Name: 2-[4-(1-oxo-2-thiophen-2-ylethyl)-1-piperazin-1-iumyl]-N-phenylacetamide IUPAC Name: N-phenyl-2-[4-(2-thiophen-2-ylacetyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-phenyl-2-[4-[2-(2-thienyl)acetyl]piperazin-1-ium-1-yl]acetamide Formula: C18H22N3O2S+ MolecularWeight: 344.45118

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2=CC=CC=C2)C(=O)CC3=CC=CS3

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2=CC=CC=C2)C(=O)CC3=CC=CS3

InChI

InChI=1S/C18H21N3O2S/c22-17(19-15-5-2-1-3-6-15)14-20-8-10-21(11-9-20)18(23)13-16-7-4-12-24-16/h1-7,12H,8-11,13-14H2,(H,19,22)/p+1