2,4,5-trimethyl-N-[3-(6-propoxypyridazin-3-yl)phenyl]benzenesulfonamide

Systemtic Name: 2,4,5-trimethyl-N-[3-(6-propoxypyridazin-3-yl)phenyl]benzenesulfonamide Openeye Name: 2,4,5-trimethyl-N-[3-(6-propoxypyridazin-3-yl)phenyl]benzenesulfonamide CAS Name: 2,4,5-trimethyl-N-[3-(6-propoxy-3-pyridazinyl)phenyl]benzenesulfonamide IUPAC Name: 2,4,5-trimethyl-N-[3-(6-propoxypyridazin-3-yl)phenyl]benzenesulfonamide Traditional Name: 2,4,5-trimethyl-N-[3-(6-propoxypyridazin-3-yl)phenyl]benzenesulfonamide Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=NN=C(C=C1)C2=CC(=CC=C2)NS(=O)(=O)C3=C(C=C(C(=C3)C)C)C

Isomeric SMILES

CCCOC1=NN=C(C=C1)C2=CC(=CC=C2)NS(=O)(=O)C3=C(C=C(C(=C3)C)C)C

InChI

InChI=1S/C22H25N3O3S/c1-5-11-28-22-10-9-20(23-24-22)18-7-6-8-19(14-18)25-29(26,27)21-13-16(3)15(2)12-17(21)4/h6-10,12-14,25H,5,11H2,1-4H3