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

Systemtic Name: methyl 4-oxidanylidene-4-[[4-(prop-2-enylsulfamoyl)phenyl]carbamothioylamino]butanoate Openeye Name: methyl 4-[[4-(allylsulfamoyl)phenyl]carbamothioylamino]-4-oxo-butanoate CAS Name: 4-oxo-4-[[[4-(prop-2-enylsulfamoyl)anilino]-sulfanylidenemethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-oxo-4-[[4-(prop-2-enylsulfamoyl)phenyl]carbamothioylamino]butanoate Traditional Name: 4-[[4-(allylsulfamoyl)phenyl]thiocarbamoylamino]-4-keto-butyric acid methyl ester Formula: C15H19N3O5S2 MolecularWeight: 385.45846

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19N3O5S2/c1-3-10-16-25(21,22)12-6-4-11(5-7-12)17-15(24)18-13(19)8-9-14(20)23-2/h3-7,16H,1,8-10H2,2H3,(H2,17,18,19,24)