propyl 4-[[4-(furan-2-ylmethylsulfamoyl)phenyl]carbamothioylamino]-4-oxidanylidene-butanoate

Systemtic Name: propyl 4-[[4-(furan-2-ylmethylsulfamoyl)phenyl]carbamothioylamino]-4-oxidanylidene-butanoate Openeye Name: propyl 4-[[4-(2-furylmethylsulfamoyl)phenyl]carbamothioylamino]-4-oxo-butanoate CAS Name: 4-[[[4-(2-furanylmethylsulfamoyl)anilino]-sulfanylidenemethyl]amino]-4-oxobutanoic acid propyl ester IUPAC Name: propyl 4-[[4-(furan-2-ylmethylsulfamoyl)phenyl]carbamothioylamino]-4-oxobutanoate Traditional Name: 4-[[4-(2-furfurylsulfamoyl)phenyl]thiocarbamoylamino]-4-keto-butyric acid propyl ester Formula: C19H23N3O6S2 MolecularWeight: 453.53242

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)CCC(=O)NC(=S)NC1=CC=C(C=C1)S(=O)(=O)NCC2=CC=CO2

Isomeric SMILES

CCCOC(=O)CCC(=O)NC(=S)NC1=CC=C(C=C1)S(=O)(=O)NCC2=CC=CO2

InChI

InChI=1S/C19H23N3O6S2/c1-2-11-28-18(24)10-9-17(23)22-19(29)21-14-5-7-16(8-6-14)30(25,26)20-13-15-4-3-12-27-15/h3-8,12,20H,2,9-11,13H2,1H3,(H2,21,22,23,29)