4-oxidanylidene-4-[[4-[2-oxidanylidene-2-[(4-sulfamoylphenyl)amino]ethyl]sulfanylphenyl]amino]butanoic acid

Systemtic Name: 4-oxidanylidene-4-[[4-[2-oxidanylidene-2-[(4-sulfamoylphenyl)amino]ethyl]sulfanylphenyl]amino]butanoic acid Openeye Name: 4-oxo-4-[4-[2-oxo-2-(4-sulfamoylanilino)ethyl]sulfanylanilino]butanoic acid CAS Name: 4-oxo-4-[4-[[2-oxo-2-(4-sulfamoylanilino)ethyl]thio]anilino]butanoic acid IUPAC Name: 4-oxo-4-[4-[2-oxo-2-(4-sulfamoylanilino)ethyl]sulfanylanilino]butanoic acid Traditional Name: 4-keto-4-[4-[[2-keto-2-(4-sulfamoylanilino)ethyl]thio]anilino]butyric acid Formula: C18H19N3O6S2 MolecularWeight: 437.48996

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)CCC(=O)O)SCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N

Isomeric SMILES

C1=CC(=CC=C1NC(=O)CCC(=O)O)SCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C18H19N3O6S2/c19-29(26,27)15-7-3-13(4-8-15)21-17(23)11-28-14-5-1-12(2-6-14)20-16(22)9-10-18(24)25/h1-8H,9-11H2,(H,20,22)(H,21,23)(H,24,25)(H2,19,26,27)