N-(2-azanylethyl)-4-iodanyl-2-(2-oxidanyl-3-pyridin-3-yloxy-propyl)-N-phenyl-benzenesulfonamide

Systemtic Name: N-(2-azanylethyl)-4-iodanyl-2-(2-oxidanyl-3-pyridin-3-yloxy-propyl)-N-phenyl-benzenesulfonamide Openeye Name: N-(2-aminoethyl)-2-[2-hydroxy-3-(3-pyridyloxy)propyl]-4-iodo-N-phenyl-benzenesulfonamide CAS Name: N-(2-aminoethyl)-2-[2-hydroxy-3-(3-pyridinyloxy)propyl]-4-iodo-N-phenylbenzenesulfonamide IUPAC Name: N-(2-aminoethyl)-2-(2-hydroxy-3-pyridin-3-yloxypropyl)-4-iodo-N-phenylbenzenesulfonamide Traditional Name: N-(2-aminoethyl)-2-[2-hydroxy-3-(3-pyridyloxy)propyl]-4-iodo-N-phenyl-benzenesulfonamide Formula: C22H24IN3O4S MolecularWeight: 553.41313

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(CCN)S(=O)(=O)C2=C(C=C(C=C2)I)CC(COC3=CN=CC=C3)O

Isomeric SMILES

C1=CC=C(C=C1)N(CCN)S(=O)(=O)C2=C(C=C(C=C2)I)CC(COC3=CN=CC=C3)O

InChI

InChI=1S/C22H24IN3O4S/c23-18-8-9-22(31(28,29)26(12-10-24)19-5-2-1-3-6-19)17(13-18)14-20(27)16-30-21-7-4-11-25-15-21/h1-9,11,13,15,20,27H,10,12,14,16,24H2