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

Systemtic Name: methyl 2-[2-butanoylsulfanylethanoyl-(2,6-dimethylphenyl)amino]ethanoate Openeye Name: methyl 2-(N-(2-butanoylsulfanylacetyl)-2,6-dimethyl-anilino)acetate CAS Name: 2-(2,6-dimethyl-N-[1-oxo-2-(1-oxobutylthio)ethyl]anilino)acetic acid methyl ester IUPAC Name: methyl 2-(N-(2-butanoylsulfanylacetyl)-2,6-dimethylanilino)acetate Traditional Name: 2-(N-[2-(butyrylthio)acetyl]-2,6-dimethyl-anilino)acetic acid methyl ester Formula: C17H23NO4S MolecularWeight: 337.43382

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23NO4S/c1-5-7-16(21)23-11-14(19)18(10-15(20)22-4)17-12(2)8-6-9-13(17)3/h6,8-9H,5,7,10-11H2,1-4H3