methyl 2-[(2,6-dimethylphenyl)-(2-propanoylsulfanylethanoyl)amino]ethanoate

Systemtic Name: methyl 2-[(2,6-dimethylphenyl)-(2-propanoylsulfanylethanoyl)amino]ethanoate Openeye Name: methyl 2-(2,6-dimethyl-N-(2-propanoylsulfanylacetyl)anilino)acetate CAS Name: 2-(2,6-dimethyl-N-[1-oxo-2-(1-oxopropylthio)ethyl]anilino)acetic acid methyl ester IUPAC Name: methyl 2-(2,6-dimethyl-N-(2-propanoylsulfanylacetyl)anilino)acetate Traditional Name: 2-(2,6-dimethyl-N-[2-(propionylthio)acetyl]anilino)acetic acid methyl ester Formula: C16H21NO4S MolecularWeight: 323.40724

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)SCC(=O)N(CC(=O)OC)C1=C(C=CC=C1C)C

Isomeric SMILES

CCC(=O)SCC(=O)N(CC(=O)OC)C1=C(C=CC=C1C)C

InChI

InChI=1S/C16H21NO4S/c1-5-15(20)22-10-13(18)17(9-14(19)21-4)16-11(2)7-6-8-12(16)3/h6-8H,5,9-10H2,1-4H3