2-(3-chloranyl-4-fluoranyl-phenyl)-4-cyclohexyl-5-(4-methylsulfanylphenyl)pyridazin-3-one

Systemtic Name: 2-(3-chloranyl-4-fluoranyl-phenyl)-4-cyclohexyl-5-(4-methylsulfanylphenyl)pyridazin-3-one Openeye Name: 2-(3-chloro-4-fluoro-phenyl)-4-cyclohexyl-5-(4-methylsulfanylphenyl)pyridazin-3-one CAS Name: 2-(3-chloro-4-fluorophenyl)-4-cyclohexyl-5-[4-(methylthio)phenyl]-3-pyridazinone IUPAC Name: 2-(3-chloro-4-fluorophenyl)-4-cyclohexyl-5-(4-methylsulfanylphenyl)pyridazin-3-one Traditional Name: 2-(3-chloro-4-fluoro-phenyl)-4-cyclohexyl-5-[4-(methylthio)phenyl]pyridazin-3-one Formula: C23H22ClFN2OS MolecularWeight: 428.949983

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C2=C(C(=O)N(N=C2)C3=CC(=C(C=C3)F)Cl)C4CCCCC4

Isomeric SMILES

CSC1=CC=C(C=C1)C2=C(C(=O)N(N=C2)C3=CC(=C(C=C3)F)Cl)C4CCCCC4

InChI

InChI=1S/C23H22ClFN2OS/c1-29-18-10-7-15(8-11-18)19-14-26-27(17-9-12-21(25)20(24)13-17)23(28)22(19)16-5-3-2-4-6-16/h7-14,16H,2-6H2,1H3