N-[2-(3-iodanylpiperazin-1-yl)-4-propyl-phenyl]-2-oxidanyl-benzenesulfonamide

Systemtic Name: N-[2-(3-iodanylpiperazin-1-yl)-4-propyl-phenyl]-2-oxidanyl-benzenesulfonamide Openeye Name: 2-hydroxy-N-[2-(3-iodopiperazin-1-yl)-4-propyl-phenyl]benzenesulfonamide CAS Name: 2-hydroxy-N-[2-(3-iodo-1-piperazinyl)-4-propylphenyl]benzenesulfonamide IUPAC Name: 2-hydroxy-N-[2-(3-iodopiperazin-1-yl)-4-propylphenyl]benzenesulfonamide Traditional Name: 2-hydroxy-N-[2-(3-iodopiperazino)-4-propyl-phenyl]benzenesulfonamide Formula: C19H24IN3O3S MolecularWeight: 501.38163

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(C=C1)NS(=O)(=O)C2=CC=CC=C2O)N3CCNC(C3)I

Isomeric SMILES

CCCC1=CC(=C(C=C1)NS(=O)(=O)C2=CC=CC=C2O)N3CCNC(C3)I

InChI

InChI=1S/C19H24IN3O3S/c1-2-5-14-8-9-15(16(12-14)23-11-10-21-19(20)13-23)22-27(25,26)18-7-4-3-6-17(18)24/h3-4,6-9,12,19,21-22,24H,2,5,10-11,13H2,1H3