1-(2-pyridin-4-ylethyl)-4-thiophen-2-ylsulfonyl-piperazin-1-ium

Systemtic Name: 1-(2-pyridin-4-ylethyl)-4-thiophen-2-ylsulfonyl-piperazin-1-ium Openeye Name: 1-[2-(4-pyridyl)ethyl]-4-(2-thienylsulfonyl)piperazin-1-ium CAS Name: 1-(2-pyridin-4-ylethyl)-4-thiophen-2-ylsulfonylpiperazin-1-ium IUPAC Name: 1-(2-pyridin-4-ylethyl)-4-thiophen-2-ylsulfonylpiperazin-1-ium Traditional Name: 1-[2-(4-pyridyl)ethyl]-4-(2-thienylsulfonyl)piperazin-1-ium Formula: C15H20N3O2S2+ MolecularWeight: 338.4682

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCC2=CC=NC=C2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

C1CN(CC[NH+]1CCC2=CC=NC=C2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C15H19N3O2S2/c19-22(20,15-2-1-13-21-15)18-11-9-17(10-12-18)8-5-14-3-6-16-7-4-14/h1-4,6-7,13H,5,8-12H2/p+1