[2-[[2-(cyanomethylsulfanyl)phenyl]amino]-2-oxidanylidene-ethyl] 2-(3-ethanoylphenoxy)ethanoate

Systemtic Name: [2-[[2-(cyanomethylsulfanyl)phenyl]amino]-2-oxidanylidene-ethyl] 2-(3-ethanoylphenoxy)ethanoate Openeye Name: [2-[2-(cyanomethylsulfanyl)anilino]-2-oxo-ethyl] 2-(3-acetylphenoxy)acetate CAS Name: 2-(3-acetylphenoxy)acetic acid [2-[2-(cyanomethylthio)anilino]-2-oxoethyl] ester IUPAC Name: [2-[2-(cyanomethylsulfanyl)anilino]-2-oxoethyl] 2-(3-acetylphenoxy)acetate Traditional Name: 2-(3-acetylphenoxy)acetic acid [2-[2-(cyanomethylthio)anilino]-2-keto-ethyl] ester Formula: C20H18N2O5S MolecularWeight: 398.43232

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)OCC(=O)OCC(=O)NC2=CC=CC=C2SCC#N

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)OCC(=O)OCC(=O)NC2=CC=CC=C2SCC#N

InChI

InChI=1S/C20H18N2O5S/c1-14(23)15-5-4-6-16(11-15)26-13-20(25)27-12-19(24)22-17-7-2-3-8-18(17)28-10-9-21/h2-8,11H,10,12-13H2,1H3,(H,22,24)