2,6-ditert-butyl-4-[1H-imidazol-2-ylmethylsulfanyl(sulfanyl)methylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 2,6-ditert-butyl-4-[1H-imidazol-2-ylmethylsulfanyl(sulfanyl)methylidene]cyclohexa-2,5-dien-1-one Openeye Name: 2,6-ditert-butyl-4-[1H-imidazol-2-ylmethylsulfanyl(sulfanyl)methylene]cyclohexa-2,5-dien-1-one CAS Name: 2,6-ditert-butyl-4-[(1H-imidazol-2-ylmethylthio)-mercaptomethylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 2,6-ditert-butyl-4-[1H-imidazol-2-ylmethylsulfanyl(sulfanyl)methylidene]cyclohexa-2,5-dien-1-one Traditional Name: 2,6-ditert-butyl-4-[(1H-imidazol-2-ylmethylthio)-mercapto-methylene]cyclohexa-2,5-dien-1-one Formula: C19H26N2OS2 MolecularWeight: 362.55254

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(S)SCC2=NC=CN2)C=C(C1=O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=C(S)SCC2=NC=CN2)C=C(C1=O)C(C)(C)C

InChI

InChI=1S/C19H26N2OS2/c1-18(2,3)13-9-12(10-14(16(13)22)19(4,5)6)17(23)24-11-15-20-7-8-21-15/h7-10,23H,11H2,1-6H3,(H,20,21)