2-[[(2S)-1,4-bis(sulfanyl)butan-2-yl]carbamoyloxy]ethyl-trimethyl-azanium iodide

Systemtic Name: 2-[[(2S)-1,4-bis(sulfanyl)butan-2-yl]carbamoyloxy]ethyl-trimethyl-azanium iodide Openeye Name: trimethyl-[2-[[(1S)-3-sulfanyl-1-(sulfanylmethyl)propyl]carbamoyloxy]ethyl]ammonium iodide CAS Name: 2-[[[(2S)-1,4-dimercaptobutan-2-yl]amino]-oxomethoxy]ethyl-trimethylammonium iodide IUPAC Name: 2-[[(2S)-1,4-bis(sulfanyl)butan-2-yl]carbamoyloxy]ethyl-trimethylazanium iodide Traditional Name: 2-[[(1S)-3-mercapto-1-(mercaptomethyl)propyl]carbamoyloxy]ethyl-trimethyl-ammonium iodide Formula: C10H23IN2O2S2 MolecularWeight: 394.33629

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCOC(=O)NC(CCS)CS.[I-]

Isomeric SMILES

C[N+](C)(C)CCOC(=O)N[C@@H](CCS)CS.[I-]

InChI

InChI=1S/C10H22N2O2S2.HI/c1-12(2,3)5-6-14-10(13)11-9(8-16)4-7-15;/h9H,4-8H2,1-3H3,(H2-,11,13,15,16);1H/t9-;/m0./s1