N-[2-(3-methoxypiperazin-1-yl)-4-(2-methylpropyl)phenyl]-2-oxidanyl-benzenesulfonamide

Systemtic Name: N-[2-(3-methoxypiperazin-1-yl)-4-(2-methylpropyl)phenyl]-2-oxidanyl-benzenesulfonamide Openeye Name: 2-hydroxy-N-[4-isobutyl-2-(3-methoxypiperazin-1-yl)phenyl]benzenesulfonamide CAS Name: 2-hydroxy-N-[2-(3-methoxy-1-piperazinyl)-4-(2-methylpropyl)phenyl]benzenesulfonamide IUPAC Name: 2-hydroxy-N-[2-(3-methoxypiperazin-1-yl)-4-(2-methylpropyl)phenyl]benzenesulfonamide Traditional Name: 2-hydroxy-N-[4-isobutyl-2-(3-methoxypiperazino)phenyl]benzenesulfonamide Formula: C21H29N3O4S MolecularWeight: 419.53766

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC(=C(C=C1)NS(=O)(=O)C2=CC=CC=C2O)N3CCNC(C3)OC

Isomeric SMILES

CC(C)CC1=CC(=C(C=C1)NS(=O)(=O)C2=CC=CC=C2O)N3CCNC(C3)OC

InChI

InChI=1S/C21H29N3O4S/c1-15(2)12-16-8-9-17(18(13-16)24-11-10-22-21(14-24)28-3)23-29(26,27)20-7-5-4-6-19(20)25/h4-9,13,15,21-23,25H,10-12,14H2,1-3H3