propyl 2-morpholin-4-yl-5-(2-phenylsulfanylethanoylamino)benzoate

Systemtic Name: propyl 2-morpholin-4-yl-5-(2-phenylsulfanylethanoylamino)benzoate Openeye Name: propyl 2-morpholino-5-[(2-phenylsulfanylacetyl)amino]benzoate CAS Name: 2-(4-morpholinyl)-5-[[1-oxo-2-(phenylthio)ethyl]amino]benzoic acid propyl ester IUPAC Name: propyl 2-morpholin-4-yl-5-[(2-phenylsulfanylacetyl)amino]benzoate Traditional Name: 2-morpholino-5-[[2-(phenylthio)acetyl]amino]benzoic acid propyl ester Formula: C22H26N2O4S MolecularWeight: 414.51784

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(C=CC(=C1)NC(=O)CSC2=CC=CC=C2)N3CCOCC3

Isomeric SMILES

CCCOC(=O)C1=C(C=CC(=C1)NC(=O)CSC2=CC=CC=C2)N3CCOCC3

InChI

InChI=1S/C22H26N2O4S/c1-2-12-28-22(26)19-15-17(8-9-20(19)24-10-13-27-14-11-24)23-21(25)16-29-18-6-4-3-5-7-18/h3-9,15H,2,10-14,16H2,1H3,(H,23,25)