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Bis[((Z)-N-(2-allyllimino)-4,9-dioxonaphtho[2,3-d]thiazol-3(2H,4H,9H)-yl)-furan-2-carboxamido(1-)-N,N,N]copper(II)
SpectraBase Compound ID DMwcMuqbw9T
InChI InChI=1S/2C19H13N3O4S.Cu/c2*1-2-9-20-19-22(21-18(25)13-8-5-10-26-13)14-15(23)11-6-3-4-7-12(11)16(24)17(14)27-19;/h2*2-8,10H,1,9H2,(H,21,25);/q;;+2/p-2/b2*20-19-;
InChIKey MQJXZVNREOVFCD-MNFFHSFDSA-L
Mol Weight 820.31 g/mol
Molecular Formula C38H24CuN6O8S2
Exact Mass 819.039301 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KW5XT2FMtAK
Name Bis[((Z)-N-(2-allyllimino)-4,9-dioxonaphtho[2,3-d]thiazol-3(2H,4H,9H)-yl)-furan-2-carboxamido(1-)-N,N,N]copper(II)
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Formula C38H24CuN6O8S2
InChI InChI=1S/2C19H13N3O4S.Cu/c2*1-2-9-20-19-22(21-18(25)13-8-5-10-26-13)14-15(23)11-6-3-4-7-12(11)16(24)17(14)27-19;/h2*2-8,10H,1,9H2,(H,21,25);/q;;+2/p-2/b2*20-19-;
InChIKey MQJXZVNREOVFCD-MNFFHSFDSA-L
Literature Reference DOI 10.1002/cjoc.201600195
Molecular Weight 820.310 g/mol
SMILES c1cc2c(cc1)C(C1=C(C2=O)S\C(N1[N-]C(=O)c1ccco1)=N/CC=C)=O.[Cu+2].c1ccc2C(=O)C=3N([N-]C(=O)c4occc4)\C(=N\CC=C)SC3C(=O)c2c1
SPLASH splash10-002g-9250100000-064e5fcc2561b45a2fba
Source of Spectrum CJC-34-821-5f
Synonyms copper(II) (Z)-(2-(allylimino)-4,9-dioxo-4,9-dihydronaphtho[2,3-d]thiazol-3(2H)-yl)(furan-2-carbonyl)amide
Wiley ID 1799315