4-[4-[1-[(4-chlorophenyl)sulfonylamino]hexyl]phenyl]sulfanylbutanoic acid

Systemtic Name: 4-[4-[1-[(4-chlorophenyl)sulfonylamino]hexyl]phenyl]sulfanylbutanoic acid Openeye Name: 4-[4-[1-[(4-chlorophenyl)sulfonylamino]hexyl]phenyl]sulfanylbutanoic acid CAS Name: 4-[[4-[1-[(4-chlorophenyl)sulfonylamino]hexyl]phenyl]thio]butanoic acid IUPAC Name: 4-[4-[1-[(4-chlorophenyl)sulfonylamino]hexyl]phenyl]sulfanylbutanoic acid Traditional Name: 4-[[4-[1-[(4-chlorophenyl)sulfonylamino]hexyl]phenyl]thio]butyric acid Formula: C22H28ClNO4S2 MolecularWeight: 470.04502

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C1=CC=C(C=C1)SCCCC(=O)O)NS(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCCCCC(C1=CC=C(C=C1)SCCCC(=O)O)NS(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C22H28ClNO4S2/c1-2-3-4-6-21(24-30(27,28)20-14-10-18(23)11-15-20)17-8-12-19(13-9-17)29-16-5-7-22(25)26/h8-15,21,24H,2-7,16H2,1H3,(H,25,26)