N-(4-chloranyl-3-fluoranyl-phenyl)-2-[6-(3,4-dimethoxyphenyl)pyridazin-3-yl]sulfanyl-ethanamide

Systemtic Name: N-(4-chloranyl-3-fluoranyl-phenyl)-2-[6-(3,4-dimethoxyphenyl)pyridazin-3-yl]sulfanyl-ethanamide Openeye Name: N-(4-chloro-3-fluoro-phenyl)-2-[6-(3,4-dimethoxyphenyl)pyridazin-3-yl]sulfanyl-acetamide CAS Name: N-(4-chloro-3-fluorophenyl)-2-[[6-(3,4-dimethoxyphenyl)-3-pyridazinyl]thio]acetamide IUPAC Name: N-(4-chloro-3-fluorophenyl)-2-[6-(3,4-dimethoxyphenyl)pyridazin-3-yl]sulfanylacetamide Traditional Name: N-(4-chloro-3-fluoro-phenyl)-2-[[6-(3,4-dimethoxyphenyl)pyridazin-3-yl]thio]acetamide Formula: C20H17ClFN3O3S MolecularWeight: 433.883683

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN=C(C=C2)SCC(=O)NC3=CC(=C(C=C3)Cl)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN=C(C=C2)SCC(=O)NC3=CC(=C(C=C3)Cl)F)OC

InChI

InChI=1S/C20H17ClFN3O3S/c1-27-17-7-3-12(9-18(17)28-2)16-6-8-20(25-24-16)29-11-19(26)23-13-4-5-14(21)15(22)10-13/h3-10H,11H2,1-2H3,(H,23,26)