(2-azanyl-2-oxidanylidene-1-phenyl-ethyl) 2-(oxolan-2-ylmethylsulfanyl)benzoate

Systemtic Name: (2-azanyl-2-oxidanylidene-1-phenyl-ethyl) 2-(oxolan-2-ylmethylsulfanyl)benzoate Openeye Name: (2-amino-2-oxo-1-phenyl-ethyl) 2-(tetrahydrofuran-2-ylmethylsulfanyl)benzoate CAS Name: 2-(2-oxolanylmethylthio)benzoic acid (2-amino-2-oxo-1-phenylethyl) ester IUPAC Name: (2-amino-2-oxo-1-phenylethyl) 2-(oxolan-2-ylmethylsulfanyl)benzoate Traditional Name: 2-(tetrahydrofurfurylthio)benzoic acid (2-amino-2-keto-1-phenyl-ethyl) ester Formula: C20H21NO4S MolecularWeight: 371.45004

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CSC2=CC=CC=C2C(=O)OC(C3=CC=CC=C3)C(=O)N

Isomeric SMILES

C1CC(OC1)CSC2=CC=CC=C2C(=O)OC(C3=CC=CC=C3)C(=O)N

InChI

InChI=1S/C20H21NO4S/c21-19(22)18(14-7-2-1-3-8-14)25-20(23)16-10-4-5-11-17(16)26-13-15-9-6-12-24-15/h1-5,7-8,10-11,15,18H,6,9,12-13H2,(H2,21,22)