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

Systemtic Name: N-(2-methoxyphenyl)-3-[(3-pyridin-3-ylpropanoylamino)carbamoyl]benzenesulfonamide Openeye Name: N-(2-methoxyphenyl)-3-[[3-(3-pyridyl)propanoylamino]carbamoyl]benzenesulfonamide CAS Name: N-(2-methoxyphenyl)-3-[oxo-[[1-oxo-3-(3-pyridinyl)propyl]hydrazo]methyl]benzenesulfonamide IUPAC Name: N-(2-methoxyphenyl)-3-[(3-pyridin-3-ylpropanoylamino)carbamoyl]benzenesulfonamide Traditional Name: N-(2-methoxyphenyl)-3-[[3-(3-pyridyl)propanoylamino]carbamoyl]benzenesulfonamide Formula: C22H22N4O5S MolecularWeight: 454.49888

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NS(=O)(=O)C2=CC=CC(=C2)C(=O)NNC(=O)CCC3=CN=CC=C3

Isomeric SMILES

COC1=CC=CC=C1NS(=O)(=O)C2=CC=CC(=C2)C(=O)NNC(=O)CCC3=CN=CC=C3

InChI

InChI=1S/C22H22N4O5S/c1-31-20-10-3-2-9-19(20)26-32(29,30)18-8-4-7-17(14-18)22(28)25-24-21(27)12-11-16-6-5-13-23-15-16/h2-10,13-15,26H,11-12H2,1H3,(H,24,27)(H,25,28)