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4-[2-(4-Bromobenzylidene)hydrazinyl]-1-(4-methoxyphenyl)-3-(methylsulfanyl)-1H-pyrazolo[3,4-d]pyrimidine
SpectraBase Compound ID F9rLx1plYYx
InChI InChI=1S/C20H17BrN6OS/c1-28-16-9-7-15(8-10-16)27-19-17(20(26-27)29-2)18(22-12-23-19)25-24-11-13-3-5-14(21)6-4-13/h3-12H,1-2H3,(H,22,23,25)/b24-11+
InChIKey MMOUWYIDYGLUNM-BHGWPJFGSA-N
Mol Weight 469.36 g/mol
Molecular Formula C20H17BrN6OS
Exact Mass 468.036793 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID x38Ufbo3e1
Name 4-[2-(4-Bromobenzylidene)hydrazinyl]-1-(4-methoxyphenyl)-3-(methylsulfanyl)-1H-pyrazolo[3,4-d]pyrimidine
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Formula C20H17BrN6OS
InChI InChI=1S/C20H17BrN6OS/c1-28-16-9-7-15(8-10-16)27-19-17(20(26-27)29-2)18(22-12-23-19)25-24-11-13-3-5-14(21)6-4-13/h3-12H,1-2H3,(H,22,23,25)/b24-11+
InChIKey MMOUWYIDYGLUNM-BHGWPJFGSA-N
Molecular Weight 469.361 g/mol
SMILES N(\N=C\c1ccc(cc1)Br)c1c2c([n](nc2SC)-c2ccc(cc2)OC)ncn1
SPLASH splash10-0far-2920100000-81a31fc4a62f44eee034
Source of Spectrum EMC-57-327-6j
Synonyms (E)-4-(2-(4-bromobenzylidene)hydrazinyl)-1-(4-methoxyphenyl)-3-(methylthio)-1H-pyrazolo[3,4-d]pyrimidine N-[(E)-(4-bromophenyl)methylideneamino]-1-(4-methoxyphenyl)-3-(methylthio)-4-pyrazolo[3,4-d]pyrimidinamine N-[(E)-(4-bromophenyl)methylideneamino]-1-(4-methoxyphenyl)-3-methylsulfanylpyrazolo[3,4-d]pyrimidin-4-amine N-[(E)-(4-bromophenyl)methyleneamino]-1-(4-methoxyphenyl)-3-methylsulfanyl-pyrazolo[3,4-d]pyrimidin-4-amine N-[(E)-(4-bromophenyl)methylideneamino]-1-(4-methoxyphenyl)-3-methylsulfanyl-pyrazolo[3,4-d]pyrimidin-4-amine
Wiley ID 1734811