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

Systemtic Name: N-(2,5-dimethylphenyl)-2-[6-(2,4-dimethylphenyl)pyridazin-3-yl]sulfanyl-ethanamide Openeye Name: N-(2,5-dimethylphenyl)-2-[6-(2,4-dimethylphenyl)pyridazin-3-yl]sulfanyl-acetamide CAS Name: N-(2,5-dimethylphenyl)-2-[[6-(2,4-dimethylphenyl)-3-pyridazinyl]thio]acetamide IUPAC Name: N-(2,5-dimethylphenyl)-2-[6-(2,4-dimethylphenyl)pyridazin-3-yl]sulfanylacetamide Traditional Name: N-(2,5-dimethylphenyl)-2-[[6-(2,4-dimethylphenyl)pyridazin-3-yl]thio]acetamide Formula: C22H23N3OS MolecularWeight: 377.50252

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23N3OS/c1-14-6-8-18(17(4)11-14)19-9-10-22(25-24-19)27-13-21(26)23-20-12-15(2)5-7-16(20)3/h5-12H,13H2,1-4H3,(H,23,26)