2-methoxyethyl 4-oxidanylidene-4-[(4-sulfamoylphenyl)carbamothioylamino]butanoate

Systemtic Name: 2-methoxyethyl 4-oxidanylidene-4-[(4-sulfamoylphenyl)carbamothioylamino]butanoate Openeye Name: 2-methoxyethyl 4-oxo-4-[(4-sulfamoylphenyl)carbamothioylamino]butanoate CAS Name: 4-oxo-4-[[(4-sulfamoylanilino)-sulfanylidenemethyl]amino]butanoic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 4-oxo-4-[(4-sulfamoylphenyl)carbamothioylamino]butanoate Traditional Name: 4-keto-4-[(4-sulfamoylphenyl)thiocarbamoylamino]butyric acid 2-methoxyethyl ester Formula: C14H19N3O6S2 MolecularWeight: 389.44716

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19N3O6S2/c1-22-8-9-23-13(19)7-6-12(18)17-14(24)16-10-2-4-11(5-3-10)25(15,20)21/h2-5H,6-9H2,1H3,(H2,15,20,21)(H2,16,17,18,24)