(2-benzamido-2-oxidanylidene-ethyl) 2-[[(2S)-oxolan-2-yl]methylsulfanyl]benzoate

Systemtic Name: (2-benzamido-2-oxidanylidene-ethyl) 2-[[(2S)-oxolan-2-yl]methylsulfanyl]benzoate Openeye Name: (2-benzamido-2-oxo-ethyl) 2-[[(2S)-tetrahydrofuran-2-yl]methylsulfanyl]benzoate CAS Name: 2-[[(2S)-2-oxolanyl]methylthio]benzoic acid (2-benzamido-2-oxoethyl) ester IUPAC Name: (2-benzamido-2-oxoethyl) 2-[[(2S)-oxolan-2-yl]methylsulfanyl]benzoate Traditional Name: 2-[[(2S)-tetrahydrofuran-2-yl]methylthio]benzoic acid (2-benzamido-2-keto-ethyl) ester Formula: C21H21NO5S MolecularWeight: 399.46014

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21NO5S/c23-19(22-20(24)15-7-2-1-3-8-15)13-27-21(25)17-10-4-5-11-18(17)28-14-16-9-6-12-26-16/h1-5,7-8,10-11,16H,6,9,12-14H2,(H,22,23,24)/t16-/m0/s1