4-oxidanyl-1-[2-[(4-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 4-oxidanyl-1-[2-[(4-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 4-hydroxy-1-[2-[(4-isopropyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]pyrrolidine-2-carboxylic acid CAS Name: 4-hydroxy-1-[1-oxo-2-[(4-propan-2-yl-1,2,4-triazol-3-yl)thio]ethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 4-hydroxy-1-[2-[(4-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]pyrrolidine-2-carboxylic acid Traditional Name: 4-hydroxy-1-[2-[(4-isopropyl-1,2,4-triazol-3-yl)thio]acetyl]proline Formula: C12H18N4O4S MolecularWeight: 314.36072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NN=C1SCC(=O)N2CC(CC2C(=O)O)O

Isomeric SMILES

CC(C)N1C=NN=C1SCC(=O)N2CC(CC2C(=O)O)O

InChI

InChI=1S/C12H18N4O4S/c1-7(2)16-6-13-14-12(16)21-5-10(18)15-4-8(17)3-9(15)11(19)20/h6-9,17H,3-5H2,1-2H3,(H,19,20)