(2R,4R)-2-(1,5-dimethylpyrazol-4-yl)-1,3-thiazolidin-3-ium-4-carboxylate

Systemtic Name: (2R,4R)-2-(1,5-dimethylpyrazol-4-yl)-1,3-thiazolidin-3-ium-4-carboxylate Openeye Name: (2R,4R)-2-(1,5-dimethylpyrazol-4-yl)thiazolidin-3-ium-4-carboxylate CAS Name: (2R,4R)-2-(1,5-dimethyl-4-pyrazolyl)-4-thiazolidin-3-iumcarboxylate IUPAC Name: (2R,4R)-2-(1,5-dimethylpyrazol-4-yl)-1,3-thiazolidin-3-ium-4-carboxylate Traditional Name: (2R,4R)-2-(1,5-dimethylpyrazol-4-yl)thiazolidin-3-ium-4-carboxylate Formula: C9H13N3O2S MolecularWeight: 227.28342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C)C2[NH2+]C(CS2)C(=O)[O-]

Isomeric SMILES

CC1=C(C=NN1C)[C@@H]2[NH2+][C@@H](CS2)C(=O)[O-]

InChI

InChI=1S/C9H13N3O2S/c1-5-6(3-10-12(5)2)8-11-7(4-15-8)9(13)14/h3,7-8,11H,4H2,1-2H3,(H,13,14)/t7-,8+/m0/s1