2-oxidanyl-5-[[5-(1-oxidanylidenebutan-2-ylcarbamoyl)pyrazin-2-yl]methylsulfamoyl]benzoic acid

Systemtic Name: 2-oxidanyl-5-[[5-(1-oxidanylidenebutan-2-ylcarbamoyl)pyrazin-2-yl]methylsulfamoyl]benzoic acid Openeye Name: 5-[[5-(1-formylpropylcarbamoyl)pyrazin-2-yl]methylsulfamoyl]-2-hydroxy-benzoic acid CAS Name: 2-hydroxy-5-[[5-[oxo-(1-oxobutan-2-ylamino)methyl]-2-pyrazinyl]methylsulfamoyl]benzoic acid IUPAC Name: 2-hydroxy-5-[[5-(1-oxobutan-2-ylcarbamoyl)pyrazin-2-yl]methylsulfamoyl]benzoic acid Traditional Name: 5-[[5-(1-formylpropylcarbamoyl)pyrazin-2-yl]methylsulfamoyl]-2-hydroxy-benzoic acid Formula: C17H18N4O7S MolecularWeight: 422.41242

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C=O)NC(=O)C1=CN=C(C=N1)CNS(=O)(=O)C2=CC(=C(C=C2)O)C(=O)O

Isomeric SMILES

CCC(C=O)NC(=O)C1=CN=C(C=N1)CNS(=O)(=O)C2=CC(=C(C=C2)O)C(=O)O

InChI

InChI=1S/C17H18N4O7S/c1-2-10(9-22)21-16(24)14-8-18-11(6-19-14)7-20-29(27,28)12-3-4-15(23)13(5-12)17(25)26/h3-6,8-10,20,23H,2,7H2,1H3,(H,21,24)(H,25,26)