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

Systemtic Name: methyl 2-[(2,6-dimethylphenyl)-[2-(phenylcarbonylsulfanyl)ethanoyl]amino]ethanoate Openeye Name: methyl 2-(N-(2-benzoylsulfanylacetyl)-2,6-dimethyl-anilino)acetate CAS Name: 2-(N-[2-(benzoylthio)-1-oxoethyl]-2,6-dimethylanilino)acetic acid methyl ester IUPAC Name: methyl 2-(N-(2-benzoylsulfanylacetyl)-2,6-dimethylanilino)acetate Traditional Name: 2-(N-[2-(benzoylthio)acetyl]-2,6-dimethyl-anilino)acetic acid methyl ester Formula: C20H21NO4S MolecularWeight: 371.45004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N(CC(=O)OC)C(=O)CSC(=O)C2=CC=CC=C2

Isomeric SMILES

CC1=C(C(=CC=C1)C)N(CC(=O)OC)C(=O)CSC(=O)C2=CC=CC=C2

InChI

InChI=1S/C20H21NO4S/c1-14-8-7-9-15(2)19(14)21(12-18(23)25-3)17(22)13-26-20(24)16-10-5-4-6-11-16/h4-11H,12-13H2,1-3H3