methyl 3-[2-[2-(4-methylphenyl)sulfanylethylamino]-2-oxidanylidene-ethoxy]benzoate

Systemtic Name: methyl 3-[2-[2-(4-methylphenyl)sulfanylethylamino]-2-oxidanylidene-ethoxy]benzoate Openeye Name: methyl 3-[2-oxo-2-[2-(p-tolylsulfanyl)ethylamino]ethoxy]benzoate CAS Name: 3-[2-[2-[(4-methylphenyl)thio]ethylamino]-2-oxoethoxy]benzoic acid methyl ester IUPAC Name: methyl 3-[2-[2-(4-methylphenyl)sulfanylethylamino]-2-oxoethoxy]benzoate Traditional Name: 3-[2-keto-2-[2-(p-tolylthio)ethylamino]ethoxy]benzoic acid methyl ester Formula: C19H21NO4S MolecularWeight: 359.43934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNC(=O)COC2=CC=CC(=C2)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)SCCNC(=O)COC2=CC=CC(=C2)C(=O)OC

InChI

InChI=1S/C19H21NO4S/c1-14-6-8-17(9-7-14)25-11-10-20-18(21)13-24-16-5-3-4-15(12-16)19(22)23-2/h3-9,12H,10-11,13H2,1-2H3,(H,20,21)