N-[3,4-bis(oxidanyl)-1-pyridin-4-yl-octan-2-yl]-2-(methylsulfonylamino)-1,3-thiazole-4-carboxamide

Systemtic Name: N-[3,4-bis(oxidanyl)-1-pyridin-4-yl-octan-2-yl]-2-(methylsulfonylamino)-1,3-thiazole-4-carboxamide Openeye Name: N-[2,3-dihydroxy-1-(4-pyridylmethyl)heptyl]-2-(methanesulfonamido)thiazole-4-carboxamide CAS Name: N-(3,4-dihydroxy-1-pyridin-4-yloctan-2-yl)-2-(methanesulfonamido)-4-thiazolecarboxamide IUPAC Name: N-(3,4-dihydroxy-1-pyridin-4-yloctan-2-yl)-2-(methanesulfonamido)-1,3-thiazole-4-carboxamide Traditional Name: N-[2,3-dihydroxy-1-(4-pyridylmethyl)heptyl]-2-(methanesulfonamido)thiazole-4-carboxamide Formula: C18H26N4O5S2 MolecularWeight: 442.55284

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(C(CC1=CC=NC=C1)NC(=O)C2=CSC(=N2)NS(=O)(=O)C)O)O

Isomeric SMILES

CCCCC(C(C(CC1=CC=NC=C1)NC(=O)C2=CSC(=N2)NS(=O)(=O)C)O)O

InChI

InChI=1S/C18H26N4O5S2/c1-3-4-5-15(23)16(24)13(10-12-6-8-19-9-7-12)20-17(25)14-11-28-18(21-14)22-29(2,26)27/h6-9,11,13,15-16,23-24H,3-5,10H2,1-2H3,(H,20,25)(H,21,22)