5-[6-(4,4-dimethyl-5-oxidanyl-5-oxidanylidene-pentyl)sulfanylpyridazin-3-yl]sulfanyl-2,2,3,3-tetramethyl-pentanoic acid

Systemtic Name: 5-[6-(4,4-dimethyl-5-oxidanyl-5-oxidanylidene-pentyl)sulfanylpyridazin-3-yl]sulfanyl-2,2,3,3-tetramethyl-pentanoic acid Openeye Name: 5-[6-(5-hydroxy-4,4-dimethyl-5-oxo-pentyl)sulfanylpyridazin-3-yl]sulfanyl-2,2,3,3-tetramethyl-pentanoic acid CAS Name: 5-[[6-[(5-hydroxy-4,4-dimethyl-5-oxopentyl)thio]-3-pyridazinyl]thio]-2,2,3,3-tetramethylpentanoic acid IUPAC Name: 5-[6-(5-hydroxy-4,4-dimethyl-5-oxopentyl)sulfanylpyridazin-3-yl]sulfanyl-2,2,3,3-tetramethylpentanoic acid Traditional Name: 5-[[6-[(5-hydroxy-5-keto-4,4-dimethyl-pentyl)thio]pyridazin-3-yl]thio]-2,2,3,3-tetramethyl-valeric acid Formula: C20H32N2O4S2 MolecularWeight: 428.60908

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCSC1=NN=C(C=C1)SCCC(C)(C)C(C)(C)C(=O)O)C(=O)O

Isomeric SMILES

CC(C)(CCCSC1=NN=C(C=C1)SCCC(C)(C)C(C)(C)C(=O)O)C(=O)O

InChI

InChI=1S/C20H32N2O4S2/c1-18(2,16(23)24)10-7-12-27-14-8-9-15(22-21-14)28-13-11-19(3,4)20(5,6)17(25)26/h8-9H,7,10-13H2,1-6H3,(H,23,24)(H,25,26)