(2S)-2-[4-(1,3-thiazol-2-yl)piperazin-1-ium-1-yl]propanoate

Systemtic Name: (2S)-2-[4-(1,3-thiazol-2-yl)piperazin-1-ium-1-yl]propanoate Openeye Name: (2S)-2-(4-thiazol-2-ylpiperazin-1-ium-1-yl)propanoate CAS Name: (2S)-2-[4-(2-thiazolyl)-1-piperazin-1-iumyl]propanoate IUPAC Name: (2S)-2-[4-(1,3-thiazol-2-yl)piperazin-1-ium-1-yl]propanoate Traditional Name: (2S)-2-(4-thiazol-2-ylpiperazin-1-ium-1-yl)propionate Formula: C10H15N3O2S MolecularWeight: 241.31

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])[NH+]1CCN(CC1)C2=NC=CS2

Isomeric SMILES

C[C@@H](C(=O)[O-])[NH+]1CCN(CC1)C2=NC=CS2

InChI

InChI=1S/C10H15N3O2S/c1-8(9(14)15)12-3-5-13(6-4-12)10-11-2-7-16-10/h2,7-8H,3-6H2,1H3,(H,14,15)/t8-/m0/s1