6-dodecylsulfanylphthalazine-1,4-dione

Systemtic Name: 6-dodecylsulfanylphthalazine-1,4-dione Openeye Name: 6-dodecylsulfanylphthalazine-1,4-dione CAS Name: 6-(dodecylthio)phthalazine-1,4-dione IUPAC Name: 6-dodecylsulfanylphthalazine-1,4-dione Traditional Name: 6-(laurylthio)phthalazine-1,4-quinone Formula: C20H28N2O2S MolecularWeight: 360.51352

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSC1=CC2=C(C=C1)C(=O)N=NC2=O

Isomeric SMILES

CCCCCCCCCCCCSC1=CC2=C(C=C1)C(=O)N=NC2=O

InChI

InChI=1S/C20H28N2O2S/c1-2-3-4-5-6-7-8-9-10-11-14-25-16-12-13-17-18(15-16)20(24)22-21-19(17)23/h12-13,15H,2-11,14H2,1H3