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

Systemtic Name: N-(3,5-dimethoxyphenyl)-2-[6-(2,4-dimethoxyphenyl)pyridazin-3-yl]sulfanyl-ethanamide Openeye Name: N-(3,5-dimethoxyphenyl)-2-[6-(2,4-dimethoxyphenyl)pyridazin-3-yl]sulfanyl-acetamide CAS Name: N-(3,5-dimethoxyphenyl)-2-[[6-(2,4-dimethoxyphenyl)-3-pyridazinyl]thio]acetamide IUPAC Name: N-(3,5-dimethoxyphenyl)-2-[6-(2,4-dimethoxyphenyl)pyridazin-3-yl]sulfanylacetamide Traditional Name: N-(3,5-dimethoxyphenyl)-2-[[6-(2,4-dimethoxyphenyl)pyridazin-3-yl]thio]acetamide Formula: C22H23N3O5S MolecularWeight: 441.50012

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23N3O5S/c1-27-15-5-6-18(20(12-15)30-4)19-7-8-22(25-24-19)31-13-21(26)23-14-9-16(28-2)11-17(10-14)29-3/h5-12H,13H2,1-4H3,(H,23,26)