2-[[5-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylamino]-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate

Systemtic Name: 2-[[5-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylamino]-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate Openeye Name: 2-[[5-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylamino]-1,3,4-thiadiazol-2-yl]sulfanyl]acetate CAS Name: 2-[[5-[[(2S)-1-ethyl-2-pyrrolidin-1-iumyl]methylamino]-1,3,4-thiadiazol-2-yl]thio]acetate IUPAC Name: 2-[[5-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylamino]-1,3,4-thiadiazol-2-yl]sulfanyl]acetate Traditional Name: 2-[[5-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methylamino]-1,3,4-thiadiazol-2-yl]thio]acetate Formula: C11H18N4O2S2 MolecularWeight: 302.41622

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1CNC2=NN=C(S2)SCC(=O)[O-]

Isomeric SMILES

CC[NH+]1CCC[C@H]1CNC2=NN=C(S2)SCC(=O)[O-]

InChI

InChI=1S/C11H18N4O2S2/c1-2-15-5-3-4-8(15)6-12-10-13-14-11(19-10)18-7-9(16)17/h8H,2-7H2,1H3,(H,12,13)(H,16,17)/t8-/m0/s1