methyl 2-[2-sulfanylethanoyl-(2,3,6-trimethylphenyl)amino]ethanoate

Systemtic Name: methyl 2-[2-sulfanylethanoyl-(2,3,6-trimethylphenyl)amino]ethanoate Openeye Name: methyl 2-(2,3,6-trimethyl-N-(2-sulfanylacetyl)anilino)acetate CAS Name: 2-(N-(2-mercapto-1-oxoethyl)-2,3,6-trimethylanilino)acetic acid methyl ester IUPAC Name: methyl 2-(2,3,6-trimethyl-N-(2-sulfanylacetyl)anilino)acetate Traditional Name: 2-(N-(2-mercaptoacetyl)-2,3,6-trimethyl-anilino)acetic acid methyl ester Formula: C14H19NO3S MolecularWeight: 281.37056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C)N(CC(=O)OC)C(=O)CS)C

Isomeric SMILES

CC1=C(C(=C(C=C1)C)N(CC(=O)OC)C(=O)CS)C

InChI

InChI=1S/C14H19NO3S/c1-9-5-6-10(2)14(11(9)3)15(12(16)8-19)7-13(17)18-4/h5-6,19H,7-8H2,1-4H3