(2S,4S)-2-(5-bromanylthiophen-2-yl)-1,3-thiazolidin-3-ium-4-carboxylate

Systemtic Name: (2S,4S)-2-(5-bromanylthiophen-2-yl)-1,3-thiazolidin-3-ium-4-carboxylate Openeye Name: (2S,4S)-2-(5-bromo-2-thienyl)thiazolidin-3-ium-4-carboxylate CAS Name: (2S,4S)-2-(5-bromo-2-thiophenyl)-4-thiazolidin-3-iumcarboxylate IUPAC Name: (2S,4S)-2-(5-bromothiophen-2-yl)-1,3-thiazolidin-3-ium-4-carboxylate Traditional Name: (2S,4S)-2-(5-bromo-2-thienyl)thiazolidin-3-ium-4-carboxylate Formula: C8H8BrNO2S2 MolecularWeight: 294.18862

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Descriptors Computed from Structure

Canonical SMILES:

C1C([NH2+]C(S1)C2=CC=C(S2)Br)C(=O)[O-]

Isomeric SMILES

C1[C@@H]([NH2+][C@@H](S1)C2=CC=C(S2)Br)C(=O)[O-]

InChI

InChI=1S/C8H8BrNO2S2/c9-6-2-1-5(14-6)7-10-4(3-13-7)8(11)12/h1-2,4,7,10H,3H2,(H,11,12)/t4-,7+/m1/s1