methyl 4-[2-[2-(2,4-dimethylphenyl)sulfanylethanoyloxy]ethanoylamino]butanoate

Systemtic Name: methyl 4-[2-[2-(2,4-dimethylphenyl)sulfanylethanoyloxy]ethanoylamino]butanoate Openeye Name: methyl 4-[[2-[2-(2,4-dimethylphenyl)sulfanylacetyl]oxyacetyl]amino]butanoate CAS Name: 4-[[2-[2-[(2,4-dimethylphenyl)thio]-1-oxoethoxy]-1-oxoethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[[2-[2-(2,4-dimethylphenyl)sulfanylacetyl]oxyacetyl]amino]butanoate Traditional Name: 4-[[2-[2-[(2,4-dimethylphenyl)thio]acetyl]oxyacetyl]amino]butyric acid methyl ester Formula: C17H23NO5S MolecularWeight: 353.43322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)SCC(=O)OCC(=O)NCCCC(=O)OC)C

Isomeric SMILES

CC1=CC(=C(C=C1)SCC(=O)OCC(=O)NCCCC(=O)OC)C

InChI

InChI=1S/C17H23NO5S/c1-12-6-7-14(13(2)9-12)24-11-17(21)23-10-15(19)18-8-4-5-16(20)22-3/h6-7,9H,4-5,8,10-11H2,1-3H3,(H,18,19)