ethyl 2-[2-[2-(2,5-dimethylphenyl)sulfanylethanoyloxy]ethanoylamino]benzoate

Systemtic Name: ethyl 2-[2-[2-(2,5-dimethylphenyl)sulfanylethanoyloxy]ethanoylamino]benzoate Openeye Name: ethyl 2-[[2-[2-(2,5-dimethylphenyl)sulfanylacetyl]oxyacetyl]amino]benzoate CAS Name: 2-[[2-[2-[(2,5-dimethylphenyl)thio]-1-oxoethoxy]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-[[2-[2-(2,5-dimethylphenyl)sulfanylacetyl]oxyacetyl]amino]benzoate Traditional Name: 2-[[2-[2-[(2,5-dimethylphenyl)thio]acetyl]oxyacetyl]amino]benzoic acid ethyl ester Formula: C21H23NO5S MolecularWeight: 401.47602

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1NC(=O)COC(=O)CSC2=C(C=CC(=C2)C)C

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1NC(=O)COC(=O)CSC2=C(C=CC(=C2)C)C

InChI

InChI=1S/C21H23NO5S/c1-4-26-21(25)16-7-5-6-8-17(16)22-19(23)12-27-20(24)13-28-18-11-14(2)9-10-15(18)3/h5-11H,4,12-13H2,1-3H3,(H,22,23)