2-[6-(2,5-dimethylphenyl)pyridazin-3-yl]sulfanyl-N-(3-ethanoylphenyl)ethanamide

Systemtic Name: 2-[6-(2,5-dimethylphenyl)pyridazin-3-yl]sulfanyl-N-(3-ethanoylphenyl)ethanamide Openeye Name: N-(3-acetylphenyl)-2-[6-(2,5-dimethylphenyl)pyridazin-3-yl]sulfanyl-acetamide CAS Name: N-(3-acetylphenyl)-2-[[6-(2,5-dimethylphenyl)-3-pyridazinyl]thio]acetamide IUPAC Name: N-(3-acetylphenyl)-2-[6-(2,5-dimethylphenyl)pyridazin-3-yl]sulfanylacetamide Traditional Name: N-(3-acetylphenyl)-2-[[6-(2,5-dimethylphenyl)pyridazin-3-yl]thio]acetamide Formula: C22H21N3O2S MolecularWeight: 391.48604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C2=NN=C(C=C2)SCC(=O)NC3=CC=CC(=C3)C(=O)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)C2=NN=C(C=C2)SCC(=O)NC3=CC=CC(=C3)C(=O)C

InChI

InChI=1S/C22H21N3O2S/c1-14-7-8-15(2)19(11-14)20-9-10-22(25-24-20)28-13-21(27)23-18-6-4-5-17(12-18)16(3)26/h4-12H,13H2,1-3H3,(H,23,27)