2-(4-ethoxyphenyl)-3-(4-methylperoxysulfanylphenyl)pyrazolo[1,5-b]pyridazine

Systemtic Name: 2-(4-ethoxyphenyl)-3-(4-methylperoxysulfanylphenyl)pyrazolo[1,5-b]pyridazine Openeye Name: 2-(4-ethoxyphenyl)-3-(4-methylperoxysulfanylphenyl)pyrazolo[1,5-b]pyridazine CAS Name: 4-[2-(4-ethoxyphenyl)-3-pyrazolo[1,5-b]pyridazinyl]benzenesulfenic acid methoxy ester IUPAC Name: 2-(4-ethoxyphenyl)-3-(4-methylperoxysulfanylphenyl)pyrazolo[1,5-b]pyridazine Traditional Name: 3-[4-(methylperoxythio)phenyl]-2-p-phenetyl-pyrazolo[1,5-b]pyridazine Formula: C21H19N3O3S MolecularWeight: 393.45886

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NN3C(=C2C4=CC=C(C=C4)SOOC)C=CC=N3

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NN3C(=C2C4=CC=C(C=C4)SOOC)C=CC=N3

InChI

InChI=1S/C21H19N3O3S/c1-3-26-17-10-6-16(7-11-17)21-20(19-5-4-14-22-24(19)23-21)15-8-12-18(13-9-15)28-27-25-2/h4-14H,3H2,1-2H3