methyl 4-methyl-3-[2-[2-(thiophen-2-ylmethylsulfanyl)ethanoyloxy]ethanoylamino]benzoate

Systemtic Name: methyl 4-methyl-3-[2-[2-(thiophen-2-ylmethylsulfanyl)ethanoyloxy]ethanoylamino]benzoate Openeye Name: methyl 4-methyl-3-[[2-[2-(2-thienylmethylsulfanyl)acetyl]oxyacetyl]amino]benzoate CAS Name: 4-methyl-3-[[1-oxo-2-[1-oxo-2-(thiophen-2-ylmethylthio)ethoxy]ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[[2-[2-(thiophen-2-ylmethylsulfanyl)acetyl]oxyacetyl]amino]benzoate Traditional Name: 4-methyl-3-[[2-[2-(2-thenylthio)acetyl]oxyacetyl]amino]benzoic acid methyl ester Formula: C18H19NO5S2 MolecularWeight: 393.47716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)COC(=O)CSCC2=CC=CS2

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)COC(=O)CSCC2=CC=CS2

InChI

InChI=1S/C18H19NO5S2/c1-12-5-6-13(18(22)23-2)8-15(12)19-16(20)9-24-17(21)11-25-10-14-4-3-7-26-14/h3-8H,9-11H2,1-2H3,(H,19,20)