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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)COC(=O)CSCC2=CC=CS2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)COC(=O)CSCC2=CC=CS2

InChI

InChI=1S/C18H19NO5S2/c1-23-18(22)14-6-4-13(5-7-14)9-19-16(20)10-24-17(21)12-25-11-15-3-2-8-26-15/h2-8H,9-12H2,1H3,(H,19,20)