3-[5-[(4-chlorophenyl)sulfonylamino]pentylsulfanyl]-3-methyl-butanoic acid

Systemtic Name: 3-[5-[(4-chlorophenyl)sulfonylamino]pentylsulfanyl]-3-methyl-butanoic acid Openeye Name: 3-[5-[(4-chlorophenyl)sulfonylamino]pentylsulfanyl]-3-methyl-butanoic acid CAS Name: 3-[5-[(4-chlorophenyl)sulfonylamino]pentylthio]-3-methylbutanoic acid IUPAC Name: 3-[5-[(4-chlorophenyl)sulfonylamino]pentylsulfanyl]-3-methylbutanoic acid Traditional Name: 3-[5-[(4-chlorophenyl)sulfonylamino]pentylthio]-3-methyl-butyric acid Formula: C16H24ClNO4S2 MolecularWeight: 393.94906

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H24ClNO4S2/c1-16(2,12-15(19)20)23-11-5-3-4-10-18-24(21,22)14-8-6-13(17)7-9-14/h6-9,18H,3-5,10-12H2,1-2H3,(H,19,20)