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1-AMINO-2-METHYLTHIO-4-PHENYL-5-(4-PHENYL-3,5-DIOXO-1,2,4-TRIAZOLIDIN-1-YL)-1-IMIDAZOLE
SpectraBase Compound ID KjCfxu0XtvF
InChI InChI=1S/C18H16N6O2S/c1-27-17-20-14(12-8-4-2-5-9-12)15(23(17)19)24-18(26)22(16(25)21-24)13-10-6-3-7-11-13/h2-11H,19H2,1H3,(H,21,25)
InChIKey ASYWJEZJGGQFHS-UHFFFAOYSA-N
Mol Weight 380.43 g/mol
Molecular Formula C18H16N6O2S
Exact Mass 380.105545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LBLxFcTBbBb
Name 1-Amino-2-methylthio-4-phenyl-5-(4'-phenyl-3',5'-dioxo-1',2',4'-triazolidin-1'-yl)-1H-imidazole
Alternate Name(s) 1-[1-amino-2-(methylsulfanyl)-4-phenyl-1H-imidazol-5-yl]-4-phenyl-1,2,4-triazolidine-3,5-dione 1-[3-amino-2-(methylthio)-5-phenyl-4-imidazolyl]-4-phenyl-1,2,4-triazolidine-3,5-dione 1-(3-amino-2-methylsulfanyl-5-phenylimidazol-4-yl)-4-phenyl-1,2,4-triazolidine-3,5-dione 1-(3-amino-2-methylsulfanyl-5-phenyl-imidazol-4-yl)-4-phenyl-1,2,4-triazolidine-3,5-dione 1-(3-azanyl-2-methylsulfanyl-5-phenyl-imidazol-4-yl)-4-phenyl-1,2,4-triazolidine-3,5-dione
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Formula C18H16N6O2S
InChI InChI=1S/C18H16N6O2S/c1-27-17-20-14(12-8-4-2-5-9-12)15(23(17)19)24-18(26)22(16(25)21-24)13-10-6-3-7-11-13/h2-11H,19H2,1H3,(H,21,25)
InChIKey ASYWJEZJGGQFHS-UHFFFAOYSA-N
Molecular Weight 380.426 g/mol
SMILES N[n]1c(N2C(N(C(N2)=O)c2ccccc2)=O)c(nc1SC)-c1ccccc1
SPLASH splash10-014i-0912000000-17828d81405c80b094ea
Source of Spectrum Y-33-44-21
Wiley ID 1359555