4-(4-phenylsulfanylbutanoylamino)butanoic acid

Systemtic Name: 4-(4-phenylsulfanylbutanoylamino)butanoic acid Openeye Name: 4-(4-phenylsulfanylbutanoylamino)butanoic acid CAS Name: 4-[[1-oxo-4-(phenylthio)butyl]amino]butanoic acid IUPAC Name: 4-(4-phenylsulfanylbutanoylamino)butanoic acid Traditional Name: 4-[4-(phenylthio)butanoylamino]butyric acid Formula: C14H19NO3S MolecularWeight: 281.37056

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCCC(=O)NCCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)SCCCC(=O)NCCCC(=O)O

InChI

InChI=1S/C14H19NO3S/c16-13(15-10-4-9-14(17)18)8-5-11-19-12-6-2-1-3-7-12/h1-3,6-7H,4-5,8-11H2,(H,15,16)(H,17,18)