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

Systemtic Name: 1-(pyridin-2-ylmethyl)-4-thiophen-2-ylsulfonyl-piperazin-1-ium Openeye Name: 1-(2-pyridylmethyl)-4-(2-thienylsulfonyl)piperazin-1-ium CAS Name: 1-(2-pyridinylmethyl)-4-thiophen-2-ylsulfonylpiperazin-1-ium IUPAC Name: 1-(pyridin-2-ylmethyl)-4-thiophen-2-ylsulfonylpiperazin-1-ium Traditional Name: 1-(2-pyridylmethyl)-4-(2-thienylsulfonyl)piperazin-1-ium Formula: C14H18N3O2S2+ MolecularWeight: 324.44162

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=N2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=N2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C14H17N3O2S2/c18-21(19,14-5-3-11-20-14)17-9-7-16(8-10-17)12-13-4-1-2-6-15-13/h1-6,11H,7-10,12H2/p+1