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

Systemtic Name: N-(4-acetamidophenyl)-2-[6-(2,5-dimethylphenyl)pyridazin-3-yl]sulfanyl-ethanamide Openeye Name: N-(4-acetamidophenyl)-2-[6-(2,5-dimethylphenyl)pyridazin-3-yl]sulfanyl-acetamide CAS Name: N-(4-acetamidophenyl)-2-[[6-(2,5-dimethylphenyl)-3-pyridazinyl]thio]acetamide IUPAC Name: N-(4-acetamidophenyl)-2-[6-(2,5-dimethylphenyl)pyridazin-3-yl]sulfanylacetamide Traditional Name: N-(4-acetamidophenyl)-2-[[6-(2,5-dimethylphenyl)pyridazin-3-yl]thio]acetamide Formula: C22H22N4O2S MolecularWeight: 406.50068

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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=C(C=C3)NC(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C22H22N4O2S/c1-14-4-5-15(2)19(12-14)20-10-11-22(26-25-20)29-13-21(28)24-18-8-6-17(7-9-18)23-16(3)27/h4-12H,13H2,1-3H3,(H,23,27)(H,24,28)