N-[5-cyano-3,4-bis(oxidanyl)-1-phenyl-pentan-2-yl]-2-(methylsulfonylamino)-1,3-oxazole-4-carboxamide

Systemtic Name: N-[5-cyano-3,4-bis(oxidanyl)-1-phenyl-pentan-2-yl]-2-(methylsulfonylamino)-1,3-oxazole-4-carboxamide Openeye Name: N-(1-benzyl-4-cyano-2,3-dihydroxy-butyl)-2-(methanesulfonamido)oxazole-4-carboxamide CAS Name: N-(5-cyano-3,4-dihydroxy-1-phenylpentan-2-yl)-2-(methanesulfonamido)-4-oxazolecarboxamide IUPAC Name: N-(5-cyano-3,4-dihydroxy-1-phenylpentan-2-yl)-2-(methanesulfonamido)-1,3-oxazole-4-carboxamide Traditional Name: N-(1-benzyl-4-cyano-2,3-dihydroxy-butyl)-2-(methanesulfonamido)oxazole-4-carboxamide Formula: C17H20N4O6S MolecularWeight: 408.4289

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=NC(=CO1)C(=O)NC(CC2=CC=CC=C2)C(C(CC#N)O)O

Isomeric SMILES

CS(=O)(=O)NC1=NC(=CO1)C(=O)NC(CC2=CC=CC=C2)C(C(CC#N)O)O

InChI

InChI=1S/C17H20N4O6S/c1-28(25,26)21-17-20-13(10-27-17)16(24)19-12(15(23)14(22)7-8-18)9-11-5-3-2-4-6-11/h2-6,10,12,14-15,22-23H,7,9H2,1H3,(H,19,24)(H,20,21)