[2-oxidanylidene-2-(2-phenylsulfanylethylamino)ethyl] (2R)-2-(4-cyanophenoxy)propanoate

Systemtic Name: [2-oxidanylidene-2-(2-phenylsulfanylethylamino)ethyl] (2R)-2-(4-cyanophenoxy)propanoate Openeye Name: [2-oxo-2-(2-phenylsulfanylethylamino)ethyl] (2R)-2-(4-cyanophenoxy)propanoate CAS Name: (2R)-2-(4-cyanophenoxy)propanoic acid [2-oxo-2-[2-(phenylthio)ethylamino]ethyl] ester IUPAC Name: [2-oxo-2-(2-phenylsulfanylethylamino)ethyl] (2R)-2-(4-cyanophenoxy)propanoate Traditional Name: (2R)-2-(4-cyanophenoxy)propionic acid [2-keto-2-[2-(phenylthio)ethylamino]ethyl] ester Formula: C20H20N2O4S MolecularWeight: 384.4488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC(=O)NCCSC1=CC=CC=C1)OC2=CC=C(C=C2)C#N

Isomeric SMILES

C[C@H](C(=O)OCC(=O)NCCSC1=CC=CC=C1)OC2=CC=C(C=C2)C#N

InChI

InChI=1S/C20H20N2O4S/c1-15(26-17-9-7-16(13-21)8-10-17)20(24)25-14-19(23)22-11-12-27-18-5-3-2-4-6-18/h2-10,15H,11-12,14H2,1H3,(H,22,23)/t15-/m1/s1