4-butylsulfanyl-2-[[4-(4-chlorophenyl)phenyl]sulfonylamino]butanoic acid

Systemtic Name: 4-butylsulfanyl-2-[[4-(4-chlorophenyl)phenyl]sulfonylamino]butanoic acid Openeye Name: 4-butylsulfanyl-2-[[4-(4-chlorophenyl)phenyl]sulfonylamino]butanoic acid CAS Name: 4-(butylthio)-2-[[4-(4-chlorophenyl)phenyl]sulfonylamino]butanoic acid IUPAC Name: 4-butylsulfanyl-2-[[4-(4-chlorophenyl)phenyl]sulfonylamino]butanoic acid Traditional Name: 4-(butylthio)-2-[[4-(4-chlorophenyl)phenyl]sulfonylamino]butyric acid Formula: C20H24ClNO4S2 MolecularWeight: 441.99186

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSCCC(C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCCCSCCC(C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C20H24ClNO4S2/c1-2-3-13-27-14-12-19(20(23)24)22-28(25,26)18-10-6-16(7-11-18)15-4-8-17(21)9-5-15/h4-11,19,22H,2-3,12-14H2,1H3,(H,23,24)