[3-oxidanyl-1,4-bis(sulfanyl)butan-2-yl] 2-(phenoxymethyl)-1,3-thiazole-4-carboxylate

Systemtic Name: [3-oxidanyl-1,4-bis(sulfanyl)butan-2-yl] 2-(phenoxymethyl)-1,3-thiazole-4-carboxylate Openeye Name: [2-hydroxy-3-sulfanyl-1-(sulfanylmethyl)propyl] 2-(phenoxymethyl)thiazole-4-carboxylate CAS Name: 2-(phenoxymethyl)-4-thiazolecarboxylic acid (3-hydroxy-1,4-dimercaptobutan-2-yl) ester IUPAC Name: [3-hydroxy-1,4-bis(sulfanyl)butan-2-yl] 2-(phenoxymethyl)-1,3-thiazole-4-carboxylate Traditional Name: 2-(phenoxymethyl)thiazole-4-carboxylic acid [2-hydroxy-3-mercapto-1-(mercaptomethyl)propyl] ester Formula: C15H17NO4S3 MolecularWeight: 371.49478

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC2=NC(=CS2)C(=O)OC(CS)C(CS)O

Isomeric SMILES

C1=CC=C(C=C1)OCC2=NC(=CS2)C(=O)OC(CS)C(CS)O

InChI

InChI=1S/C15H17NO4S3/c17-12(7-21)13(8-22)20-15(18)11-9-23-14(16-11)6-19-10-4-2-1-3-5-10/h1-5,9,12-13,17,21-22H,6-8H2