N-[7-methylsulfanyl-3,4-bis(oxidanyl)-1-pyridin-4-yl-heptan-2-yl]-2-(methylsulfonylamino)-1,3-oxazole-4-carboxamide

Systemtic Name: N-[7-methylsulfanyl-3,4-bis(oxidanyl)-1-pyridin-4-yl-heptan-2-yl]-2-(methylsulfonylamino)-1,3-oxazole-4-carboxamide Openeye Name: N-[2,3-dihydroxy-6-methylsulfanyl-1-(4-pyridylmethyl)hexyl]-2-(methanesulfonamido)oxazole-4-carboxamide CAS Name: N-[3,4-dihydroxy-7-(methylthio)-1-pyridin-4-ylheptan-2-yl]-2-(methanesulfonamido)-4-oxazolecarboxamide IUPAC Name: N-(3,4-dihydroxy-7-methylsulfanyl-1-pyridin-4-ylheptan-2-yl)-2-(methanesulfonamido)-1,3-oxazole-4-carboxamide Traditional Name: N-[2,3-dihydroxy-6-(methylthio)-1-(4-pyridylmethyl)hexyl]-2-(methanesulfonamido)oxazole-4-carboxamide Formula: C18H26N4O6S2 MolecularWeight: 458.55224

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Descriptors Computed from Structure

Canonical SMILES:

CSCCCC(C(C(CC1=CC=NC=C1)NC(=O)C2=COC(=N2)NS(=O)(=O)C)O)O

Isomeric SMILES

CSCCCC(C(C(CC1=CC=NC=C1)NC(=O)C2=COC(=N2)NS(=O)(=O)C)O)O

InChI

InChI=1S/C18H26N4O6S2/c1-29-9-3-4-15(23)16(24)13(10-12-5-7-19-8-6-12)20-17(25)14-11-28-18(21-14)22-30(2,26)27/h5-8,11,13,15-16,23-24H,3-4,9-10H2,1-2H3,(H,20,25)(H,21,22)