4-[4-[2-(1,3-benzothiazol-2-ylsulfanyl)ethoxy]phenyl]sulfonyl-N-oxidanyl-oxane-4-carboxamide

Systemtic Name: 4-[4-[2-(1,3-benzothiazol-2-ylsulfanyl)ethoxy]phenyl]sulfonyl-N-oxidanyl-oxane-4-carboxamide Openeye Name: 4-[4-[2-(1,3-benzothiazol-2-ylsulfanyl)ethoxy]phenyl]sulfonyltetrahydropyran-4-carbohydroxamic acid CAS Name: 4-[4-[2-(1,3-benzothiazol-2-ylthio)ethoxy]phenyl]sulfonyl-N-hydroxy-4-oxanecarboxamide IUPAC Name: 4-[4-[2-(1,3-benzothiazol-2-ylsulfanyl)ethoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide Traditional Name: 4-[4-[2-(1,3-benzothiazol-2-ylthio)ethoxy]phenyl]sulfonyltetrahydropyran-4-carbohydroxamic acid Formula: C21H22N2O6S3 MolecularWeight: 494.60418

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1(C(=O)NO)S(=O)(=O)C2=CC=C(C=C2)OCCSC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1COCCC1(C(=O)NO)S(=O)(=O)C2=CC=C(C=C2)OCCSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H22N2O6S3/c24-19(23-25)21(9-11-28-12-10-21)32(26,27)16-7-5-15(6-8-16)29-13-14-30-20-22-17-3-1-2-4-18(17)31-20/h1-8,25H,9-14H2,(H,23,24)