4-[4-[3-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]propoxy]phenyl]sulfonyl-N-oxidanyl-oxane-4-carboxamide

Systemtic Name: 4-[4-[3-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]propoxy]phenyl]sulfonyl-N-oxidanyl-oxane-4-carboxamide Openeye Name: 4-[4-[3-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]propoxy]phenyl]sulfonyltetrahydropyran-4-carbohydroxamic acid CAS Name: 4-[4-[3-[(5-chloro-1,3-benzothiazol-2-yl)thio]propoxy]phenyl]sulfonyl-N-hydroxy-4-oxanecarboxamide IUPAC Name: 4-[4-[3-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]propoxy]phenyl]sulfonyl-N-hydroxyoxane-4-carboxamide Traditional Name: 4-[4-[3-[(5-chloro-1,3-benzothiazol-2-yl)thio]propoxy]phenyl]sulfonyltetrahydropyran-4-carbohydroxamic acid Formula: C22H23ClN2O6S3 MolecularWeight: 543.07582

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1(C(=O)NO)S(=O)(=O)C2=CC=C(C=C2)OCCCSC3=NC4=C(S3)C=CC(=C4)Cl

Isomeric SMILES

C1COCCC1(C(=O)NO)S(=O)(=O)C2=CC=C(C=C2)OCCCSC3=NC4=C(S3)C=CC(=C4)Cl

InChI

InChI=1S/C22H23ClN2O6S3/c23-15-2-7-19-18(14-15)24-21(33-19)32-13-1-10-31-16-3-5-17(6-4-16)34(28,29)22(20(26)25-27)8-11-30-12-9-22/h2-7,14,27H,1,8-13H2,(H,25,26)