propyl 4-[[2-(oxolan-2-ylmethylsulfanyl)phenyl]carbonylamino]benzoate

Systemtic Name: propyl 4-[[2-(oxolan-2-ylmethylsulfanyl)phenyl]carbonylamino]benzoate Openeye Name: propyl 4-[[2-(tetrahydrofuran-2-ylmethylsulfanyl)benzoyl]amino]benzoate CAS Name: 4-[[oxo-[2-(2-oxolanylmethylthio)phenyl]methyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[[2-(oxolan-2-ylmethylsulfanyl)benzoyl]amino]benzoate Traditional Name: 4-[[2-(tetrahydrofurfurylthio)benzoyl]amino]benzoic acid propyl ester Formula: C22H25NO4S MolecularWeight: 399.5032

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2SCC3CCCO3

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2SCC3CCCO3

InChI

InChI=1S/C22H25NO4S/c1-2-13-27-22(25)16-9-11-17(12-10-16)23-21(24)19-7-3-4-8-20(19)28-15-18-6-5-14-26-18/h3-4,7-12,18H,2,5-6,13-15H2,1H3,(H,23,24)