1-[2-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]ethanoyl]-4-oxidanyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]ethanoyl]-4-oxidanyl-pyrrolidine-2-carboxylic acid Openeye Name: 4-hydroxy-1-[2-[(2-methylthiazol-4-yl)methylsulfanyl]acetyl]pyrrolidine-2-carboxylic acid CAS Name: 4-hydroxy-1-[2-[(2-methyl-4-thiazolyl)methylthio]-1-oxoethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 4-hydroxy-1-[2-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]acetyl]pyrrolidine-2-carboxylic acid Traditional Name: 4-hydroxy-1-[2-[(2-methylthiazol-4-yl)methylthio]acetyl]proline Formula: C12H16N2O4S2 MolecularWeight: 316.39644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CSCC(=O)N2CC(CC2C(=O)O)O

Isomeric SMILES

CC1=NC(=CS1)CSCC(=O)N2CC(CC2C(=O)O)O

InChI

InChI=1S/C12H16N2O4S2/c1-7-13-8(5-20-7)4-19-6-11(16)14-3-9(15)2-10(14)12(17)18/h5,9-10,15H,2-4,6H2,1H3,(H,17,18)