2-[6-[(4-chlorophenyl)sulfonylamino]hexylsulfanyl]-2-methyl-propanoic acid

Systemtic Name: 2-[6-[(4-chlorophenyl)sulfonylamino]hexylsulfanyl]-2-methyl-propanoic acid Openeye Name: 2-[6-[(4-chlorophenyl)sulfonylamino]hexylsulfanyl]-2-methyl-propanoic acid CAS Name: 2-[6-[(4-chlorophenyl)sulfonylamino]hexylthio]-2-methylpropanoic acid IUPAC Name: 2-[6-[(4-chlorophenyl)sulfonylamino]hexylsulfanyl]-2-methylpropanoic acid Traditional Name: 2-[6-[(4-chlorophenyl)sulfonylamino]hexylthio]-2-methyl-propionic acid Formula: C16H24ClNO4S2 MolecularWeight: 393.94906

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)O)SCCCCCCNS(=O)(=O)C1=CC=C(C=C1)Cl

Isomeric SMILES

CC(C)(C(=O)O)SCCCCCCNS(=O)(=O)C1=CC=C(C=C1)Cl

InChI

InChI=1S/C16H24ClNO4S2/c1-16(2,15(19)20)23-12-6-4-3-5-11-18-24(21,22)14-9-7-13(17)8-10-14/h7-10,18H,3-6,11-12H2,1-2H3,(H,19,20)