N-(3-chloranyl-4-fluoranyl-phenyl)-2-[6-(2,5-dimethoxyphenyl)pyridazin-3-yl]sulfanyl-ethanamide

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-2-[6-(2,5-dimethoxyphenyl)pyridazin-3-yl]sulfanyl-ethanamide Openeye Name: N-(3-chloro-4-fluoro-phenyl)-2-[6-(2,5-dimethoxyphenyl)pyridazin-3-yl]sulfanyl-acetamide CAS Name: N-(3-chloro-4-fluorophenyl)-2-[[6-(2,5-dimethoxyphenyl)-3-pyridazinyl]thio]acetamide IUPAC Name: N-(3-chloro-4-fluorophenyl)-2-[6-(2,5-dimethoxyphenyl)pyridazin-3-yl]sulfanylacetamide Traditional Name: N-(3-chloro-4-fluoro-phenyl)-2-[[6-(2,5-dimethoxyphenyl)pyridazin-3-yl]thio]acetamide Formula: C20H17ClFN3O3S MolecularWeight: 433.883683

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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