1-(2,5-diethylphenyl)-2-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanyl-ethanone

Systemtic Name: 1-(2,5-diethylphenyl)-2-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanyl-ethanone Openeye Name: 1-(2,5-diethylphenyl)-2-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanyl-ethanone CAS Name: 1-(2,5-diethylphenyl)-2-[[6-(3,5-dimethyl-1-pyrazolyl)-3-pyridazinyl]thio]ethanone IUPAC Name: 1-(2,5-diethylphenyl)-2-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]sulfanylethanone Traditional Name: 1-(2,5-diethylphenyl)-2-[[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]thio]ethanone Formula: C21H24N4OS MolecularWeight: 380.50646

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)CC)C(=O)CSC2=NN=C(C=C2)N3C(=CC(=N3)C)C

Isomeric SMILES

CCC1=CC(=C(C=C1)CC)C(=O)CSC2=NN=C(C=C2)N3C(=CC(=N3)C)C

InChI

InChI=1S/C21H24N4OS/c1-5-16-7-8-17(6-2)18(12-16)19(26)13-27-21-10-9-20(22-23-21)25-15(4)11-14(3)24-25/h7-12H,5-6,13H2,1-4H3