2-[2-(1-oxidanylidenephthalazin-2-yl)sulfanylcyclohexyl]sulfanylphthalazin-1-one

Systemtic Name: 2-[2-(1-oxidanylidenephthalazin-2-yl)sulfanylcyclohexyl]sulfanylphthalazin-1-one Openeye Name: 2-[2-(1-oxophthalazin-2-yl)sulfanylcyclohexyl]sulfanylphthalazin-1-one CAS Name: 2-[[2-[(1-oxo-2-phthalazinyl)thio]cyclohexyl]thio]-1-phthalazinone IUPAC Name: 2-[2-(1-oxophthalazin-2-yl)sulfanylcyclohexyl]sulfanylphthalazin-1-one Traditional Name: 2-[[2-[(1-ketophthalazin-2-yl)thio]cyclohexyl]thio]phthalazin-1-one Formula: C22H20N4O2S2 MolecularWeight: 436.5498

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)SN2C(=O)C3=CC=CC=C3C=N2)SN4C(=O)C5=CC=CC=C5C=N4

Isomeric SMILES

C1CCC(C(C1)SN2C(=O)C3=CC=CC=C3C=N2)SN4C(=O)C5=CC=CC=C5C=N4

InChI

InChI=1S/C22H20N4O2S2/c27-21-17-9-3-1-7-15(17)13-23-25(21)29-19-11-5-6-12-20(19)30-26-22(28)18-10-4-2-8-16(18)14-24-26/h1-4,7-10,13-14,19-20H,5-6,11-12H2