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3,3'-(4,4'-Oxybis(4,1-phenylene))bis(4-imino-1-phenyl-5-thioxoimidazolidin-2-one)
SpectraBase Compound ID KCyZcPlUNrV
InChI InChI=1S/C30H20N6O3S2/c31-25-27(40)35(19-7-3-1-4-8-19)29(37)33(25)21-11-15-23(16-12-21)39-24-17-13-22(14-18-24)34-26(32)28(41)36(30(34)38)20-9-5-2-6-10-20/h1-18,31-32H
InChIKey OBIMWJQINVXRCB-UHFFFAOYSA-N
Mol Weight 576.65 g/mol
Molecular Formula C30H20N6O3S2
Exact Mass 576.103831 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5424TSEvA0
Name 3,3'-(4,4'-Oxybis(4,1-phenylene))bis(4-imino-1-phenyl-5-thioxoimidazolidin-2-one)
Alternate Name(s) 3,3'-(oxybis(4,1-phenylene))bis(4-imino-1-phenyl-5-thioxoimidazolidin-2-one) 5-Imino-1-[4-[4-(5-imino-2-oxo-3-phenyl-4-sulfanylidene-1-imidazolidinyl)phenoxy]phenyl]-3-phenyl-4-sulfanylidene-2-imidazolidinone 5-Imino-1-[4-[4-(5-imino-2-oxo-3-phenyl-4-sulfanylideneimidazolidin-1-yl)phenoxy]phenyl]-3-phenyl-4-sulfanylideneimidazolidin-2-one 5-Imino-1-[4-[4-(5-imino-2-oxo-3-phenyl-4-thioxo-imidazolidin-1-yl)phenoxy]phenyl]-3-phenyl-4-thioxo-imidazolidin-2-one 5-Azanylidene-1-[4-[4-(5-azanylidene-2-oxidanylidene-3-phenyl-4-sulfanylidene-imidazolidin-1-yl)phenoxy]phenyl]-3-phenyl-4-sulfanylidene-imidazolidin-2-one
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Formula C30H20N6O3S2
InChI InChI=1S/C30H20N6O3S2/c31-25-27(40)35(19-7-3-1-4-8-19)29(37)33(25)21-11-15-23(16-12-21)39-24-17-13-22(14-18-24)34-26(32)28(41)36(30(34)38)20-9-5-2-6-10-20/h1-18,31-32H
InChIKey OBIMWJQINVXRCB-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ardp.201300097
Molecular Weight 576.649 g/mol
SMILES N=C1C(N(C(N1c1ccc(Oc2ccc(N3C(C(N(C3=O)c3ccccc3)=S)=N)cc2)cc1)=O)c1ccccc1)=S
SPLASH splash10-0fbi-9850000000-0879b1f71953e4a65d6a
Source of Spectrum APC-346-552-7a
Wiley ID 1769525