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

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[6-(2-methylphenyl)pyridazin-3-yl]sulfanyl-ethanamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[6-(o-tolyl)pyridazin-3-yl]sulfanyl-acetamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[[6-(2-methylphenyl)-3-pyridazinyl]thio]acetamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[6-(2-methylphenyl)pyridazin-3-yl]sulfanylacetamide Traditional Name: N-homoveratryl-2-[[6-(o-tolyl)pyridazin-3-yl]thio]acetamide Formula: C23H25N3O3S MolecularWeight: 423.5279

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NN=C(C=C2)SCC(=O)NCCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=CC=CC=C1C2=NN=C(C=C2)SCC(=O)NCCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C23H25N3O3S/c1-16-6-4-5-7-18(16)19-9-11-23(26-25-19)30-15-22(27)24-13-12-17-8-10-20(28-2)21(14-17)29-3/h4-11,14H,12-13,15H2,1-3H3,(H,24,27)