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

Systemtic Name: 2-[6-(3,4-dimethoxyphenyl)pyridazin-3-yl]sulfanyl-N-phenethyl-ethanamide Openeye Name: 2-[6-(3,4-dimethoxyphenyl)pyridazin-3-yl]sulfanyl-N-phenethyl-acetamide CAS Name: 2-[[6-(3,4-dimethoxyphenyl)-3-pyridazinyl]thio]-N-phenethylacetamide IUPAC Name: 2-[6-(3,4-dimethoxyphenyl)pyridazin-3-yl]sulfanyl-N-phenethylacetamide Traditional Name: 2-[[6-(3,4-dimethoxyphenyl)pyridazin-3-yl]thio]-N-phenethyl-acetamide Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN=C(C=C2)SCC(=O)NCCC3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN=C(C=C2)SCC(=O)NCCC3=CC=CC=C3)OC

InChI

InChI=1S/C22H23N3O3S/c1-27-19-10-8-17(14-20(19)28-2)18-9-11-22(25-24-18)29-15-21(26)23-13-12-16-6-4-3-5-7-16/h3-11,14H,12-13,15H2,1-2H3,(H,23,26)