N-(2-chlorophenyl)-3-[(3-pyridin-3-ylpropanoylamino)carbamoyl]benzenesulfonamide

Systemtic Name: N-(2-chlorophenyl)-3-[(3-pyridin-3-ylpropanoylamino)carbamoyl]benzenesulfonamide Openeye Name: N-(2-chlorophenyl)-3-[[3-(3-pyridyl)propanoylamino]carbamoyl]benzenesulfonamide CAS Name: N-(2-chlorophenyl)-3-[oxo-[[1-oxo-3-(3-pyridinyl)propyl]hydrazo]methyl]benzenesulfonamide IUPAC Name: N-(2-chlorophenyl)-3-[(3-pyridin-3-ylpropanoylamino)carbamoyl]benzenesulfonamide Traditional Name: N-(2-chlorophenyl)-3-[[3-(3-pyridyl)propanoylamino]carbamoyl]benzenesulfonamide Formula: C21H19ClN4O4S MolecularWeight: 458.91796

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)NNC(=O)CCC3=CN=CC=C3)Cl

Isomeric SMILES

C1=CC=C(C(=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)NNC(=O)CCC3=CN=CC=C3)Cl

InChI

InChI=1S/C21H19ClN4O4S/c22-18-8-1-2-9-19(18)26-31(29,30)17-7-3-6-16(13-17)21(28)25-24-20(27)11-10-15-5-4-12-23-14-15/h1-9,12-14,26H,10-11H2,(H,24,27)(H,25,28)