[2-oxidanylidene-2-[(4-piperidin-1-ylphenyl)amino]ethyl] 2-phenylsulfanylethanoate

Systemtic Name: [2-oxidanylidene-2-[(4-piperidin-1-ylphenyl)amino]ethyl] 2-phenylsulfanylethanoate Openeye Name: [2-oxo-2-[4-(1-piperidyl)anilino]ethyl] 2-phenylsulfanylacetate CAS Name: 2-(phenylthio)acetic acid [2-oxo-2-[4-(1-piperidinyl)anilino]ethyl] ester IUPAC Name: [2-oxo-2-(4-piperidin-1-ylanilino)ethyl] 2-phenylsulfanylacetate Traditional Name: 2-(phenylthio)acetic acid [2-keto-2-(4-piperidinoanilino)ethyl] ester Formula: C21H24N2O3S MolecularWeight: 384.49186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC=C(C=C2)NC(=O)COC(=O)CSC3=CC=CC=C3

Isomeric SMILES

C1CCN(CC1)C2=CC=C(C=C2)NC(=O)COC(=O)CSC3=CC=CC=C3

InChI

InChI=1S/C21H24N2O3S/c24-20(15-26-21(25)16-27-19-7-3-1-4-8-19)22-17-9-11-18(12-10-17)23-13-5-2-6-14-23/h1,3-4,7-12H,2,5-6,13-16H2,(H,22,24)