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

Systemtic Name: N-(2,5-dimethylphenyl)-2-[6-(4-methylphenyl)pyridazin-3-yl]sulfanyl-ethanamide Openeye Name: N-(2,5-dimethylphenyl)-2-[6-(p-tolyl)pyridazin-3-yl]sulfanyl-acetamide CAS Name: N-(2,5-dimethylphenyl)-2-[[6-(4-methylphenyl)-3-pyridazinyl]thio]acetamide IUPAC Name: N-(2,5-dimethylphenyl)-2-[6-(4-methylphenyl)pyridazin-3-yl]sulfanylacetamide Traditional Name: N-(2,5-dimethylphenyl)-2-[[6-(p-tolyl)pyridazin-3-yl]thio]acetamide Formula: C21H21N3OS MolecularWeight: 363.47594

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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

Isomeric SMILES

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

InChI

InChI=1S/C21H21N3OS/c1-14-5-8-17(9-6-14)18-10-11-21(24-23-18)26-13-20(25)22-19-12-15(2)4-7-16(19)3/h4-12H,13H2,1-3H3,(H,22,25)