ethyl 4-oxidanylidene-4-[[4-(propylsulfamoyl)phenyl]carbamothioylamino]butanoate

Systemtic Name: ethyl 4-oxidanylidene-4-[[4-(propylsulfamoyl)phenyl]carbamothioylamino]butanoate Openeye Name: ethyl 4-oxo-4-[[4-(propylsulfamoyl)phenyl]carbamothioylamino]butanoate CAS Name: 4-oxo-4-[[[4-(propylsulfamoyl)anilino]-sulfanylidenemethyl]amino]butanoic acid ethyl ester IUPAC Name: ethyl 4-oxo-4-[[4-(propylsulfamoyl)phenyl]carbamothioylamino]butanoate Traditional Name: 4-keto-4-[[4-(propylsulfamoyl)phenyl]thiocarbamoylamino]butyric acid ethyl ester Formula: C16H23N3O5S2 MolecularWeight: 401.50092

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Descriptors Computed from Structure

Canonical SMILES:

CCCNS(=O)(=O)C1=CC=C(C=C1)NC(=S)NC(=O)CCC(=O)OCC

Isomeric SMILES

CCCNS(=O)(=O)C1=CC=C(C=C1)NC(=S)NC(=O)CCC(=O)OCC

InChI

InChI=1S/C16H23N3O5S2/c1-3-11-17-26(22,23)13-7-5-12(6-8-13)18-16(25)19-14(20)9-10-15(21)24-4-2/h5-8,17H,3-4,9-11H2,1-2H3,(H2,18,19,20,25)