[1-oxidanylidene-1-[[4-(pyridin-2-ylsulfamoyl)phenyl]amino]butan-2-yl] 2-chloranylpyridine-4-carboxylate

Systemtic Name: [1-oxidanylidene-1-[[4-(pyridin-2-ylsulfamoyl)phenyl]amino]butan-2-yl] 2-chloranylpyridine-4-carboxylate Openeye Name: 1-[[4-(2-pyridylsulfamoyl)phenyl]carbamoyl]propyl 2-chloropyridine-4-carboxylate CAS Name: 2-chloro-4-pyridinecarboxylic acid [1-oxo-1-[4-(2-pyridinylsulfamoyl)anilino]butan-2-yl] ester IUPAC Name: [1-oxo-1-[4-(pyridin-2-ylsulfamoyl)anilino]butan-2-yl] 2-chloropyridine-4-carboxylate Traditional Name: 2-chloroisonicotinic acid 1-[[4-(2-pyridylsulfamoyl)phenyl]carbamoyl]propyl ester Formula: C21H19ClN4O5S MolecularWeight: 474.91736

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=N2)OC(=O)C3=CC(=NC=C3)Cl

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=N2)OC(=O)C3=CC(=NC=C3)Cl

InChI

InChI=1S/C21H19ClN4O5S/c1-2-17(31-21(28)14-10-12-23-18(22)13-14)20(27)25-15-6-8-16(9-7-15)32(29,30)26-19-5-3-4-11-24-19/h3-13,17H,2H2,1H3,(H,24,26)(H,25,27)