N-[2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)sulfonylethyl]-2-thiophen-2-yl-ethanamide

Systemtic Name: N-[2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)sulfonylethyl]-2-thiophen-2-yl-ethanamide Openeye Name: N-[2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)sulfonylethyl]-2-(2-thienyl)acetamide CAS Name: N-[2-[[4-(2-pyridin-1-iumyl)-1-piperazinyl]sulfonyl]ethyl]-2-thiophen-2-ylacetamide IUPAC Name: N-[2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)sulfonylethyl]-2-thiophen-2-ylacetamide Traditional Name: N-[2-(4-pyridin-1-ium-2-ylpiperazino)sulfonylethyl]-2-(2-thienyl)acetamide Formula: C17H23N4O3S2+ MolecularWeight: 395.51952

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=[NH+]2)S(=O)(=O)CCNC(=O)CC3=CC=CS3

Isomeric SMILES

C1CN(CCN1C2=CC=CC=[NH+]2)S(=O)(=O)CCNC(=O)CC3=CC=CS3

InChI

InChI=1S/C17H22N4O3S2/c22-17(14-15-4-3-12-25-15)19-7-13-26(23,24)21-10-8-20(9-11-21)16-5-1-2-6-18-16/h1-6,12H,7-11,13-14H2,(H,19,22)/p+1