2-(4,5-dimethylpyridazin-3-yl)-5-(2-ethylsulfanylpropyl)cyclohexane-1,3-dione

Systemtic Name: 2-(4,5-dimethylpyridazin-3-yl)-5-(2-ethylsulfanylpropyl)cyclohexane-1,3-dione Openeye Name: 2-(4,5-dimethylpyridazin-3-yl)-5-(2-ethylsulfanylpropyl)cyclohexane-1,3-dione CAS Name: 2-(4,5-dimethyl-3-pyridazinyl)-5-[2-(ethylthio)propyl]cyclohexane-1,3-dione IUPAC Name: 2-(4,5-dimethylpyridazin-3-yl)-5-(2-ethylsulfanylpropyl)cyclohexane-1,3-dione Traditional Name: 2-(4,5-dimethylpyridazin-3-yl)-5-[2-(ethylthio)propyl]cyclohexane-1,3-quinone Formula: C17H24N2O2S MolecularWeight: 320.44966

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(C)CC1CC(=O)C(C(=O)C1)C2=C(C(=CN=N2)C)C

Isomeric SMILES

CCSC(C)CC1CC(=O)C(C(=O)C1)C2=C(C(=CN=N2)C)C

InChI

InChI=1S/C17H24N2O2S/c1-5-22-11(3)6-13-7-14(20)16(15(21)8-13)17-12(4)10(2)9-18-19-17/h9,11,13,16H,5-8H2,1-4H3