2-methoxy-5-[1-oxidanyl-4-(4-pyridin-2-ylpiperazin-1-yl)butyl]benzenesulfonamide

Systemtic Name: 2-methoxy-5-[1-oxidanyl-4-(4-pyridin-2-ylpiperazin-1-yl)butyl]benzenesulfonamide Openeye Name: 5-[1-hydroxy-4-[4-(2-pyridyl)piperazin-1-yl]butyl]-2-methoxy-benzenesulfonamide CAS Name: 5-[1-hydroxy-4-[4-(2-pyridinyl)-1-piperazinyl]butyl]-2-methoxybenzenesulfonamide IUPAC Name: 5-[1-hydroxy-4-(4-pyridin-2-ylpiperazin-1-yl)butyl]-2-methoxybenzenesulfonamide Traditional Name: 5-[1-hydroxy-4-[4-(2-pyridyl)piperazino]butyl]-2-methoxy-benzenesulfonamide Formula: C20H28N4O4S MolecularWeight: 420.52572

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CCCN2CCN(CC2)C3=CC=CC=N3)O)S(=O)(=O)N

Isomeric SMILES

COC1=C(C=C(C=C1)C(CCCN2CCN(CC2)C3=CC=CC=N3)O)S(=O)(=O)N

InChI

InChI=1S/C20H28N4O4S/c1-28-18-8-7-16(15-19(18)29(21,26)27)17(25)5-4-10-23-11-13-24(14-12-23)20-6-2-3-9-22-20/h2-3,6-9,15,17,25H,4-5,10-14H2,1H3,(H2,21,26,27)