methyl 4-[2-oxidanylidene-2-[2-(phenylmethylsulfanyl)ethylamino]ethoxy]benzoate

Systemtic Name: methyl 4-[2-oxidanylidene-2-[2-(phenylmethylsulfanyl)ethylamino]ethoxy]benzoate Openeye Name: methyl 4-[2-(2-benzylsulfanylethylamino)-2-oxo-ethoxy]benzoate CAS Name: 4-[2-oxo-2-[2-(phenylmethylthio)ethylamino]ethoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[2-(2-benzylsulfanylethylamino)-2-oxoethoxy]benzoate Traditional Name: 4-[2-[2-(benzylthio)ethylamino]-2-keto-ethoxy]benzoic acid methyl ester Formula: C19H21NO4S MolecularWeight: 359.43934

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)OCC(=O)NCCSCC2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)OCC(=O)NCCSCC2=CC=CC=C2

InChI

InChI=1S/C19H21NO4S/c1-23-19(22)16-7-9-17(10-8-16)24-13-18(21)20-11-12-25-14-15-5-3-2-4-6-15/h2-10H,11-14H2,1H3,(H,20,21)