4-oxidanylidene-4-[[4-(pyrimidin-2-ylsulfamoyl)phenyl]amino]butanoic acid

Systemtic Name: 4-oxidanylidene-4-[[4-(pyrimidin-2-ylsulfamoyl)phenyl]amino]butanoic acid Openeye Name: 4-oxo-4-[4-(pyrimidin-2-ylsulfamoyl)anilino]butanoic acid CAS Name: 4-oxo-4-[4-(2-pyrimidinylsulfamoyl)anilino]butanoic acid IUPAC Name: 4-oxo-4-[4-(pyrimidin-2-ylsulfamoyl)anilino]butanoic acid Traditional Name: 4-keto-4-[4-(2-pyrimidylsulfamoyl)anilino]butyric acid Formula: C14H14N4O5S MolecularWeight: 350.34976

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)CCC(=O)O

Isomeric SMILES

C1=CN=C(N=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)CCC(=O)O

InChI

InChI=1S/C14H14N4O5S/c19-12(6-7-13(20)21)17-10-2-4-11(5-3-10)24(22,23)18-14-15-8-1-9-16-14/h1-5,8-9H,6-7H2,(H,17,19)(H,20,21)(H,15,16,18)