propyl 4-oxidanylidene-4-[[4-(prop-2-enylsulfamoyl)phenyl]carbamothioylamino]butanoate

Systemtic Name: propyl 4-oxidanylidene-4-[[4-(prop-2-enylsulfamoyl)phenyl]carbamothioylamino]butanoate Openeye Name: propyl 4-[[4-(allylsulfamoyl)phenyl]carbamothioylamino]-4-oxo-butanoate CAS Name: 4-oxo-4-[[[4-(prop-2-enylsulfamoyl)anilino]-sulfanylidenemethyl]amino]butanoic acid propyl ester IUPAC Name: propyl 4-oxo-4-[[4-(prop-2-enylsulfamoyl)phenyl]carbamothioylamino]butanoate Traditional Name: 4-[[4-(allylsulfamoyl)phenyl]thiocarbamoylamino]-4-keto-butyric acid propyl ester Formula: C17H23N3O5S2 MolecularWeight: 413.51162

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)CCC(=O)NC(=S)NC1=CC=C(C=C1)S(=O)(=O)NCC=C

Isomeric SMILES

CCCOC(=O)CCC(=O)NC(=S)NC1=CC=C(C=C1)S(=O)(=O)NCC=C

InChI

InChI=1S/C17H23N3O5S2/c1-3-11-18-27(23,24)14-7-5-13(6-8-14)19-17(26)20-15(21)9-10-16(22)25-12-4-2/h3,5-8,18H,1,4,9-12H2,2H3,(H2,19,20,21,26)