N-[6-cyano-3,4-bis(oxidanyl)-1-phenyl-hexan-2-yl]-2-(methylsulfonylamino)-1,3-thiazole-4-carboxamide

Systemtic Name: N-[6-cyano-3,4-bis(oxidanyl)-1-phenyl-hexan-2-yl]-2-(methylsulfonylamino)-1,3-thiazole-4-carboxamide Openeye Name: N-(1-benzyl-5-cyano-2,3-dihydroxy-pentyl)-2-(methanesulfonamido)thiazole-4-carboxamide CAS Name: N-(6-cyano-3,4-dihydroxy-1-phenylhexan-2-yl)-2-(methanesulfonamido)-4-thiazolecarboxamide IUPAC Name: N-(6-cyano-3,4-dihydroxy-1-phenylhexan-2-yl)-2-(methanesulfonamido)-1,3-thiazole-4-carboxamide Traditional Name: N-(1-benzyl-5-cyano-2,3-dihydroxy-pentyl)-2-(methanesulfonamido)thiazole-4-carboxamide Formula: C18H22N4O5S2 MolecularWeight: 438.52108

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=NC(=CS1)C(=O)NC(CC2=CC=CC=C2)C(C(CCC#N)O)O

Isomeric SMILES

CS(=O)(=O)NC1=NC(=CS1)C(=O)NC(CC2=CC=CC=C2)C(C(CCC#N)O)O

InChI

InChI=1S/C18H22N4O5S2/c1-29(26,27)22-18-21-14(11-28-18)17(25)20-13(10-12-6-3-2-4-7-12)16(24)15(23)8-5-9-19/h2-4,6-7,11,13,15-16,23-24H,5,8,10H2,1H3,(H,20,25)(H,21,22)