[2-oxidanylidene-2-(phenethylamino)ethyl] 2-[[(2R)-oxolan-2-yl]methylsulfanyl]benzoate

Systemtic Name: [2-oxidanylidene-2-(phenethylamino)ethyl] 2-[[(2R)-oxolan-2-yl]methylsulfanyl]benzoate Openeye Name: [2-oxo-2-(phenethylamino)ethyl] 2-[[(2R)-tetrahydrofuran-2-yl]methylsulfanyl]benzoate CAS Name: 2-[[(2R)-2-oxolanyl]methylthio]benzoic acid [2-oxo-2-(phenethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(phenethylamino)ethyl] 2-[[(2R)-oxolan-2-yl]methylsulfanyl]benzoate Traditional Name: 2-[[(2R)-tetrahydrofuran-2-yl]methylthio]benzoic acid [2-keto-2-(phenethylamino)ethyl] ester Formula: C22H25NO4S MolecularWeight: 399.5032

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CSC2=CC=CC=C2C(=O)OCC(=O)NCCC3=CC=CC=C3

Isomeric SMILES

C1C[C@@H](OC1)CSC2=CC=CC=C2C(=O)OCC(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C22H25NO4S/c24-21(23-13-12-17-7-2-1-3-8-17)15-27-22(25)19-10-4-5-11-20(19)28-16-18-9-6-14-26-18/h1-5,7-8,10-11,18H,6,9,12-16H2,(H,23,24)/t18-/m1/s1