3-(4-tert-butylsulfanylphenyl)-2H-phthalazine-1,4-dione

Systemtic Name: 3-(4-tert-butylsulfanylphenyl)-2H-phthalazine-1,4-dione Openeye Name: 3-(4-tert-butylsulfanylphenyl)-2H-phthalazine-1,4-dione CAS Name: 3-[4-(tert-butylthio)phenyl]-2H-phthalazine-1,4-dione IUPAC Name: 3-(4-tert-butylsulfanylphenyl)-2H-phthalazine-1,4-dione Traditional Name: 3-[4-(tert-butylthio)phenyl]-2H-phthalazine-1,4-quinone Formula: C18H18N2O2S MolecularWeight: 326.41272

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=O)N2

Isomeric SMILES

CC(C)(C)SC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=O)N2

InChI

InChI=1S/C18H18N2O2S/c1-18(2,3)23-13-10-8-12(9-11-13)20-17(22)15-7-5-4-6-14(15)16(21)19-20/h4-11H,1-3H3,(H,19,21)