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

Systemtic Name: 2-methoxyethyl 4-oxidanylidene-4-[[4-(1,3-thiazol-2-ylsulfamoyl)phenyl]carbamothioylamino]butanoate Openeye Name: 2-methoxyethyl 4-oxo-4-[[4-(thiazol-2-ylsulfamoyl)phenyl]carbamothioylamino]butanoate CAS Name: 4-oxo-4-[[sulfanylidene-[4-(2-thiazolylsulfamoyl)anilino]methyl]amino]butanoic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 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 2-methoxyethyl ester Formula: C17H20N4O6S3 MolecularWeight: 472.5589

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20N4O6S3/c1-26-9-10-27-15(23)7-6-14(22)20-16(28)19-12-2-4-13(5-3-12)30(24,25)21-17-18-8-11-29-17/h2-5,8,11H,6-7,9-10H2,1H3,(H,18,21)(H2,19,20,22,28)