sodium (2S)-4-sulfanyl-2-(1,3-thiazol-2-ylamino)butanoate

Systemtic Name: sodium (2S)-4-sulfanyl-2-(1,3-thiazol-2-ylamino)butanoate Openeye Name: sodium (2S)-4-sulfanyl-2-(thiazol-2-ylamino)butanoate CAS Name: sodium (2S)-4-mercapto-2-(2-thiazolylamino)butanoate IUPAC Name: sodium (2S)-4-sulfanyl-2-(1,3-thiazol-2-ylamino)butanoate Traditional Name: sodium (2S)-4-mercapto-2-(thiazol-2-ylamino)butyrate Formula: C7H9N2NaO2S2 MolecularWeight: 240.27833

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=N1)NC(CCS)C(=O)[O-].[Na+]

Isomeric SMILES

C1=CSC(=N1)N[C@@H](CCS)C(=O)[O-].[Na+]

InChI

InChI=1S/C7H10N2O2S2.Na/c10-6(11)5(1-3-12)9-7-8-2-4-13-7;/h2,4-5,12H,1,3H2,(H,8,9)(H,10,11);/q;+1/p-1/t5-;/m0./s1