[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl] 3-phenylsulfanylpropanoate

Systemtic Name: [2-oxidanylidene-2-[(phenylmethyl)amino]ethyl] 3-phenylsulfanylpropanoate Openeye Name: [2-(benzylamino)-2-oxo-ethyl] 3-phenylsulfanylpropanoate CAS Name: 3-(phenylthio)propanoic acid [2-oxo-2-[(phenylmethyl)amino]ethyl] ester IUPAC Name: [2-(benzylamino)-2-oxoethyl] 3-phenylsulfanylpropanoate Traditional Name: 3-(phenylthio)propionic acid [2-(benzylamino)-2-keto-ethyl] ester Formula: C18H19NO3S MolecularWeight: 329.41336

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)COC(=O)CCSC2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)COC(=O)CCSC2=CC=CC=C2

InChI

InChI=1S/C18H19NO3S/c20-17(19-13-15-7-3-1-4-8-15)14-22-18(21)11-12-23-16-9-5-2-6-10-16/h1-10H,11-14H2,(H,19,20)