[(2S)-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)-2-thiophen-2-yl-ethyl]azanium

Systemtic Name: [(2S)-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)-2-thiophen-2-yl-ethyl]azanium Openeye Name: [(2S)-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)-2-(2-thienyl)ethyl]ammonium CAS Name: [(2S)-2-[4-(2-pyridin-1-iumyl)-1-piperazinyl]-2-thiophen-2-ylethyl]ammonium IUPAC Name: [(2S)-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)-2-thiophen-2-ylethyl]azanium Traditional Name: [(2S)-2-(4-pyridin-1-ium-2-ylpiperazino)-2-(2-thienyl)ethyl]ammonium Formula: C15H22N4S+2 MolecularWeight: 290.42698

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=[NH+]2)C(C[NH3+])C3=CC=CS3

Isomeric SMILES

C1CN(CCN1C2=CC=CC=[NH+]2)[C@@H](C[NH3+])C3=CC=CS3

InChI

InChI=1S/C15H20N4S/c16-12-13(14-4-3-11-20-14)18-7-9-19(10-8-18)15-5-1-2-6-17-15/h1-6,11,13H,7-10,12,16H2/p+2/t13-/m0/s1