(2S)-3-(2-sulfanylideneimidazolidin-4-yl)-2-(trimethylazaniumyl)propanoate

Systemtic Name: (2S)-3-(2-sulfanylideneimidazolidin-4-yl)-2-(trimethylazaniumyl)propanoate Openeye Name: (2S)-3-(2-thioxoimidazolidin-4-yl)-2-(trimethylammonio)propanoate CAS Name: (2S)-3-(2-sulfanylidene-4-imidazolidinyl)-2-(trimethylammonio)propanoate IUPAC Name: (2S)-3-(2-sulfanylideneimidazolidin-4-yl)-2-(trimethylazaniumyl)propanoate Traditional Name: (2S)-3-(2-thioxoimidazolidin-4-yl)-2-(trimethylammonio)propionate Formula: C9H17N3O2S MolecularWeight: 231.31518

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)C(CC1CNC(=S)N1)C(=O)[O-]

Isomeric SMILES

C[N+](C)(C)[C@@H](CC1CNC(=S)N1)C(=O)[O-]

InChI

InChI=1S/C9H17N3O2S/c1-12(2,3)7(8(13)14)4-6-5-10-9(15)11-6/h6-7H,4-5H2,1-3H3,(H2-,10,11,13,14,15)/t6?,7-/m0/s1