[3-ethoxy-5-(2-methylsulfanylethoxy)phenyl] 2-[(4-cyanophenyl)amino]ethanoate

Systemtic Name: [3-ethoxy-5-(2-methylsulfanylethoxy)phenyl] 2-[(4-cyanophenyl)amino]ethanoate Openeye Name: [3-ethoxy-5-(2-methylsulfanylethoxy)phenyl] 2-(4-cyanoanilino)acetate CAS Name: 2-(4-cyanoanilino)acetic acid [3-ethoxy-5-[2-(methylthio)ethoxy]phenyl] ester IUPAC Name: [3-ethoxy-5-(2-methylsulfanylethoxy)phenyl] 2-(4-cyanoanilino)acetate Traditional Name: 2-(4-cyanoanilino)acetic acid [3-ethoxy-5-[2-(methylthio)ethoxy]phenyl] ester Formula: C20H22N2O4S MolecularWeight: 386.46468

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1)OC(=O)CNC2=CC=C(C=C2)C#N)OCCSC

Isomeric SMILES

CCOC1=CC(=CC(=C1)OC(=O)CNC2=CC=C(C=C2)C#N)OCCSC

InChI

InChI=1S/C20H22N2O4S/c1-3-24-17-10-18(25-8-9-27-2)12-19(11-17)26-20(23)14-22-16-6-4-15(13-21)5-7-16/h4-7,10-12,22H,3,8-9,14H2,1-2H3