propyl 4-oxidanylidene-4-[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]carbamothioylamino]butanoate

Systemtic Name: propyl 4-oxidanylidene-4-[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]carbamothioylamino]butanoate Openeye Name: propyl 4-oxo-4-[[4-(thiazol-2-ylsulfamoyl)phenyl]carbamothioylamino]butanoate CAS Name: 4-oxo-4-[[sulfanylidene-[4-(2-thiazolylsulfamoyl)anilino]methyl]amino]butanoic acid propyl ester IUPAC Name: propyl 4-oxo-4-[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]carbamothioylamino]butanoate Traditional Name: 4-keto-4-[[4-(thiazol-2-ylsulfamoyl)phenyl]thiocarbamoylamino]butyric acid propyl ester Formula: C17H20N4O5S3 MolecularWeight: 456.5595

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)CCC(=O)NC(=S)NC1=CC=C(C=C1)S(=O)(=O)NC2=NC=CS2

Isomeric SMILES

CCCOC(=O)CCC(=O)NC(=S)NC1=CC=C(C=C1)S(=O)(=O)NC2=NC=CS2

InChI

InChI=1S/C17H20N4O5S3/c1-2-10-26-15(23)8-7-14(22)20-16(27)19-12-3-5-13(6-4-12)29(24,25)21-17-18-9-11-28-17/h3-6,9,11H,2,7-8,10H2,1H3,(H,18,21)(H2,19,20,22,27)