4-[4-(4-chlorophenyl)sulfanylbutanoyl-methyl-amino]butanoic acid

Systemtic Name: 4-[4-(4-chlorophenyl)sulfanylbutanoyl-methyl-amino]butanoic acid Openeye Name: 4-[4-(4-chlorophenyl)sulfanylbutanoyl-methyl-amino]butanoic acid CAS Name: 4-[[4-[(4-chlorophenyl)thio]-1-oxobutyl]-methylamino]butanoic acid IUPAC Name: 4-[4-(4-chlorophenyl)sulfanylbutanoyl-methylamino]butanoic acid Traditional Name: 4-[4-[(4-chlorophenyl)thio]butanoyl-methyl-amino]butyric acid Formula: C15H20ClNO3S MolecularWeight: 329.8422

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(=O)O)C(=O)CCCSC1=CC=C(C=C1)Cl

Isomeric SMILES

CN(CCCC(=O)O)C(=O)CCCSC1=CC=C(C=C1)Cl

InChI

InChI=1S/C15H20ClNO3S/c1-17(10-2-5-15(19)20)14(18)4-3-11-21-13-8-6-12(16)7-9-13/h6-9H,2-5,10-11H2,1H3,(H,19,20)