N-[2,3-bis(oxidanyl)propyl]-2-butoxy-N-[3-methyl-5-[2-(pyridazin-4-ylamino)ethoxy]phenyl]benzenesulfonamide

Systemtic Name: N-[2,3-bis(oxidanyl)propyl]-2-butoxy-N-[3-methyl-5-[2-(pyridazin-4-ylamino)ethoxy]phenyl]benzenesulfonamide Openeye Name: 2-butoxy-N-(2,3-dihydroxypropyl)-N-[3-methyl-5-[2-(pyridazin-4-ylamino)ethoxy]phenyl]benzenesulfonamide CAS Name: 2-butoxy-N-(2,3-dihydroxypropyl)-N-[3-methyl-5-[2-(4-pyridazinylamino)ethoxy]phenyl]benzenesulfonamide IUPAC Name: 2-butoxy-N-(2,3-dihydroxypropyl)-N-[3-methyl-5-[2-(pyridazin-4-ylamino)ethoxy]phenyl]benzenesulfonamide Traditional Name: 2-butoxy-N-glyceryl-N-[3-methyl-5-[2-(pyridazin-4-ylamino)ethoxy]phenyl]benzenesulfonamide Formula: C26H34N4O6S MolecularWeight: 530.63636

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC=C1S(=O)(=O)N(CC(CO)O)C2=CC(=CC(=C2)C)OCCNC3=CN=NC=C3

Isomeric SMILES

CCCCOC1=CC=CC=C1S(=O)(=O)N(CC(CO)O)C2=CC(=CC(=C2)C)OCCNC3=CN=NC=C3

InChI

InChI=1S/C26H34N4O6S/c1-3-4-12-36-25-7-5-6-8-26(25)37(33,34)30(18-23(32)19-31)22-14-20(2)15-24(16-22)35-13-11-27-21-9-10-28-29-17-21/h5-10,14-17,23,31-32H,3-4,11-13,18-19H2,1-2H3,(H,27,28)