methyl 3-[2-[2-(4-methoxyphenyl)sulfanylethanoyloxy]ethanoylamino]-4-methyl-benzoate

Systemtic Name: methyl 3-[2-[2-(4-methoxyphenyl)sulfanylethanoyloxy]ethanoylamino]-4-methyl-benzoate Openeye Name: methyl 3-[[2-[2-(4-methoxyphenyl)sulfanylacetyl]oxyacetyl]amino]-4-methyl-benzoate CAS Name: 3-[[2-[2-[(4-methoxyphenyl)thio]-1-oxoethoxy]-1-oxoethyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[[2-[2-(4-methoxyphenyl)sulfanylacetyl]oxyacetyl]amino]-4-methylbenzoate Traditional Name: 3-[[2-[2-[(4-methoxyphenyl)thio]acetyl]oxyacetyl]amino]-4-methyl-benzoic acid methyl ester Formula: C20H21NO6S MolecularWeight: 403.44884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)COC(=O)CSC2=CC=C(C=C2)OC

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)COC(=O)CSC2=CC=C(C=C2)OC

InChI

InChI=1S/C20H21NO6S/c1-13-4-5-14(20(24)26-3)10-17(13)21-18(22)11-27-19(23)12-28-16-8-6-15(25-2)7-9-16/h4-10H,11-12H2,1-3H3,(H,21,22)