[2-[(3-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl] 2-[3-(4-methoxyphenyl)propanoylamino]benzoate

Systemtic Name: [2-[(3-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl] 2-[3-(4-methoxyphenyl)propanoylamino]benzoate Openeye Name: [2-(3-methylsulfanylanilino)-2-oxo-ethyl] 2-[3-(4-methoxyphenyl)propanoylamino]benzoate CAS Name: 2-[[3-(4-methoxyphenyl)-1-oxopropyl]amino]benzoic acid [2-[3-(methylthio)anilino]-2-oxoethyl] ester IUPAC Name: [2-(3-methylsulfanylanilino)-2-oxoethyl] 2-[3-(4-methoxyphenyl)propanoylamino]benzoate Traditional Name: 2-[3-(4-methoxyphenyl)propanoylamino]benzoic acid [2-keto-2-[3-(methylthio)anilino]ethyl] ester Formula: C26H26N2O5S MolecularWeight: 478.56004

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCC(=O)NC2=CC=CC=C2C(=O)OCC(=O)NC3=CC(=CC=C3)SC

Isomeric SMILES

COC1=CC=C(C=C1)CCC(=O)NC2=CC=CC=C2C(=O)OCC(=O)NC3=CC(=CC=C3)SC

InChI

InChI=1S/C26H26N2O5S/c1-32-20-13-10-18(11-14-20)12-15-24(29)28-23-9-4-3-8-22(23)26(31)33-17-25(30)27-19-6-5-7-21(16-19)34-2/h3-11,13-14,16H,12,15,17H2,1-2H3,(H,27,30)(H,28,29)