4-chloranyl-5-(3-fluoranyl-4-methylsulfanyl-phenyl)-2-(phenylmethyl)pyridazin-3-one

Systemtic Name: 4-chloranyl-5-(3-fluoranyl-4-methylsulfanyl-phenyl)-2-(phenylmethyl)pyridazin-3-one Openeye Name: 2-benzyl-4-chloro-5-(3-fluoro-4-methylsulfanyl-phenyl)pyridazin-3-one CAS Name: 4-chloro-5-[3-fluoro-4-(methylthio)phenyl]-2-(phenylmethyl)-3-pyridazinone IUPAC Name: 2-benzyl-4-chloro-5-(3-fluoro-4-methylsulfanylphenyl)pyridazin-3-one Traditional Name: 2-benzyl-4-chloro-5-[3-fluoro-4-(methylthio)phenyl]pyridazin-3-one Formula: C18H14ClFN2OS MolecularWeight: 360.832963

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(C=C1)C2=C(C(=O)N(N=C2)CC3=CC=CC=C3)Cl)F

Isomeric SMILES

CSC1=C(C=C(C=C1)C2=C(C(=O)N(N=C2)CC3=CC=CC=C3)Cl)F

InChI

InChI=1S/C18H14ClFN2OS/c1-24-16-8-7-13(9-15(16)20)14-10-21-22(18(23)17(14)19)11-12-5-3-2-4-6-12/h2-10H,11H2,1H3