methyl 4-[[2-(phenylcarbonylsulfanyl)ethanoylamino]methyl]benzoate

Systemtic Name: methyl 4-[[2-(phenylcarbonylsulfanyl)ethanoylamino]methyl]benzoate Openeye Name: methyl 4-[[(2-benzoylsulfanylacetyl)amino]methyl]benzoate CAS Name: 4-[[[2-(benzoylthio)-1-oxoethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(2-benzoylsulfanylacetyl)amino]methyl]benzoate Traditional Name: 4-[[[2-(benzoylthio)acetyl]amino]methyl]benzoic acid methyl ester Formula: C18H17NO4S MolecularWeight: 343.39688

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)CSC(=O)C2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)CSC(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H17NO4S/c1-23-17(21)14-9-7-13(8-10-14)11-19-16(20)12-24-18(22)15-5-3-2-4-6-15/h2-10H,11-12H2,1H3,(H,19,20)