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

Systemtic Name: N-tert-butyl-2-[4-(2-thiophen-2-ylethanoyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-tert-butyl-2-[4-[2-(2-thienyl)acetyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-tert-butyl-2-[4-(1-oxo-2-thiophen-2-ylethyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-tert-butyl-2-[4-(2-thiophen-2-ylacetyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-tert-butyl-2-[4-[2-(2-thienyl)acetyl]piperazin-1-ium-1-yl]acetamide Formula: C16H26N3O2S+ MolecularWeight: 324.46154

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C[NH+]1CCN(CC1)C(=O)CC2=CC=CS2

Isomeric SMILES

CC(C)(C)NC(=O)C[NH+]1CCN(CC1)C(=O)CC2=CC=CS2

InChI

InChI=1S/C16H25N3O2S/c1-16(2,3)17-14(20)12-18-6-8-19(9-7-18)15(21)11-13-5-4-10-22-13/h4-5,10H,6-9,11-12H2,1-3H3,(H,17,20)/p+1