(4S)-N-(2-cyanoethyl)-N-(pyridin-3-ylmethyl)-1,3-thiazolidin-3-ium-4-carboxamide

Systemtic Name: (4S)-N-(2-cyanoethyl)-N-(pyridin-3-ylmethyl)-1,3-thiazolidin-3-ium-4-carboxamide Openeye Name: (4S)-N-(2-cyanoethyl)-N-(3-pyridylmethyl)thiazolidin-3-ium-4-carboxamide CAS Name: (4S)-N-(2-cyanoethyl)-N-(3-pyridinylmethyl)-4-thiazolidin-3-iumcarboxamide IUPAC Name: (4S)-N-(2-cyanoethyl)-N-(pyridin-3-ylmethyl)-1,3-thiazolidin-3-ium-4-carboxamide Traditional Name: (4S)-N-(2-cyanoethyl)-N-(3-pyridylmethyl)thiazolidin-3-ium-4-carboxamide Formula: C13H17N4OS+ MolecularWeight: 277.36528

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Descriptors Computed from Structure

Canonical SMILES:

C1C([NH2+]CS1)C(=O)N(CCC#N)CC2=CN=CC=C2

Isomeric SMILES

C1[C@@H]([NH2+]CS1)C(=O)N(CCC#N)CC2=CN=CC=C2

InChI

InChI=1S/C13H16N4OS/c14-4-2-6-17(8-11-3-1-5-15-7-11)13(18)12-9-19-10-16-12/h1,3,5,7,12,16H,2,6,8-10H2/p+1/t12-/m1/s1