2-(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)-N-(2-thiophen-2-ylethyl)ethanamide

Systemtic Name: 2-(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)-N-(2-thiophen-2-ylethyl)ethanamide Openeye Name: 2-[4-(2-naphthylsulfonyl)piperazin-1-ium-1-yl]-N-[2-(2-thienyl)ethyl]acetamide CAS Name: 2-[4-(2-naphthalenylsulfonyl)-1-piperazin-1-iumyl]-N-(2-thiophen-2-ylethyl)acetamide IUPAC Name: 2-(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)-N-(2-thiophen-2-ylethyl)acetamide Traditional Name: 2-[4-(2-naphthylsulfonyl)piperazin-1-ium-1-yl]-N-[2-(2-thienyl)ethyl]acetamide Formula: C22H26N3O3S2+ MolecularWeight: 444.59014

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NCCC2=CC=CS2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NCCC2=CC=CS2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C22H25N3O3S2/c26-22(23-10-9-20-6-3-15-29-20)17-24-11-13-25(14-12-24)30(27,28)21-8-7-18-4-1-2-5-19(18)16-21/h1-8,15-16H,9-14,17H2,(H,23,26)/p+1