3-[[4-chloranyl-3-(2-methylsulfonylphenoxy)phenyl]methyl]-1H-pyridazin-6-one

Systemtic Name: 3-[[4-chloranyl-3-(2-methylsulfonylphenoxy)phenyl]methyl]-1H-pyridazin-6-one Openeye Name: 3-[[4-chloro-3-(2-methylsulfonylphenoxy)phenyl]methyl]-1H-pyridazin-6-one CAS Name: 3-[[4-chloro-3-(2-methylsulfonylphenoxy)phenyl]methyl]-1H-pyridazin-6-one IUPAC Name: 3-[[4-chloro-3-(2-methylsulfonylphenoxy)phenyl]methyl]-1H-pyridazin-6-one Traditional Name: 3-[4-chloro-3-(2-mesylphenoxy)benzyl]-1H-pyridazin-6-one Formula: C18H15ClN2O4S MolecularWeight: 390.8407

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1OC2=C(C=CC(=C2)CC3=NNC(=O)C=C3)Cl

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1OC2=C(C=CC(=C2)CC3=NNC(=O)C=C3)Cl

InChI

InChI=1S/C18H15ClN2O4S/c1-26(23,24)17-5-3-2-4-15(17)25-16-11-12(6-8-14(16)19)10-13-7-9-18(22)21-20-13/h2-9,11H,10H2,1H3,(H,21,22)