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

Systemtic Name: [5-ethyl-2-(2-methylsulfanylethoxy)phenyl] 2-[(4-cyanophenyl)amino]ethanoate Openeye Name: [5-ethyl-2-(2-methylsulfanylethoxy)phenyl] 2-(4-cyanoanilino)acetate CAS Name: 2-(4-cyanoanilino)acetic acid [5-ethyl-2-[2-(methylthio)ethoxy]phenyl] ester IUPAC Name: [5-ethyl-2-(2-methylsulfanylethoxy)phenyl] 2-(4-cyanoanilino)acetate Traditional Name: 2-(4-cyanoanilino)acetic acid [5-ethyl-2-[2-(methylthio)ethoxy]phenyl] ester Formula: C20H22N2O3S MolecularWeight: 370.46528

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OCCSC)OC(=O)CNC2=CC=C(C=C2)C#N

Isomeric SMILES

CCC1=CC(=C(C=C1)OCCSC)OC(=O)CNC2=CC=C(C=C2)C#N

InChI

InChI=1S/C20H22N2O3S/c1-3-15-6-9-18(24-10-11-26-2)19(12-15)25-20(23)14-22-17-7-4-16(13-21)5-8-17/h4-9,12,22H,3,10-11,14H2,1-2H3