2-[2,5-bis(fluoranyl)phenyl]-5-(4-methylsulfanylphenyl)-4-propoxy-pyridazin-3-one

Systemtic Name: 2-[2,5-bis(fluoranyl)phenyl]-5-(4-methylsulfanylphenyl)-4-propoxy-pyridazin-3-one Openeye Name: 2-(2,5-difluorophenyl)-5-(4-methylsulfanylphenyl)-4-propoxy-pyridazin-3-one CAS Name: 2-(2,5-difluorophenyl)-5-[4-(methylthio)phenyl]-4-propoxy-3-pyridazinone IUPAC Name: 2-(2,5-difluorophenyl)-5-(4-methylsulfanylphenyl)-4-propoxypyridazin-3-one Traditional Name: 2-(2,5-difluorophenyl)-5-[4-(methylthio)phenyl]-4-propoxy-pyridazin-3-one Formula: C20H18F2N2O2S MolecularWeight: 388.430926

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=NN(C1=O)C2=C(C=CC(=C2)F)F)C3=CC=C(C=C3)SC

Isomeric SMILES

CCCOC1=C(C=NN(C1=O)C2=C(C=CC(=C2)F)F)C3=CC=C(C=C3)SC

InChI

InChI=1S/C20H18F2N2O2S/c1-3-10-26-19-16(13-4-7-15(27-2)8-5-13)12-23-24(20(19)25)18-11-14(21)6-9-17(18)22/h4-9,11-12H,3,10H2,1-2H3