Chem
J-GLOBAL ID:200907098352665401
Nikkaji number:J2.700.584E
4-Chloro-3-(4-fluorophenyl)-6-(methylthio)-1H-pyrazolo[3,4-d]pyrimidine
4-クロロ-3-(4-フルオロフェニル)-6-(メチルチオ)-1H-ピラゾロ[3,4-d]ピリミジン
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Substance type:
Substance type
Substance type classified into 3 categories. Decided structure: Substances with a clear structure Undicided Structure: Substances with unknown or undetermined structure Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula:
C12 H8 ClFN4 S
Molecular formula furigana:
C12-H8-CL-F-N4-S
Molecular weight:
294.730
InChI:
InChI=1S/C12H8ClFN4S/c1-19-12-15-10(13)8-9(17-18-11(8)16-12)6-2-4-7(14)5-3-6/h2-5H,1H3,(H,15,16,17,18)
InChI key:
SQDMLNVNMGWECH-UHFFFAOYSA-N
SMILES:
CSc1nc(Cl)c2c(n[nH]c2n1)c1ccc(F)cc1
Systematic name (3):
4-クロロ-3-(4-フルオロフェニル)-6-(メチルチオ)-1H-ピラゾロ[3,4-d]ピリミジン
4-クロロ-3-(4-フルオロフェニル)-6-(メチルスルファニル)-1H-ピラゾロ[3,4-d]ピリミジン
4-chloro-3-(4-fluorophenyl)-6-(methylsulfanyl)-1H-pyrazolo[3,4-d]pyrimidine
Other name (1):
4-Chloro-3-(4-fluorophenyl)-6-(methylthio)-1H-pyrazolo[3,4-d]pyrimidine
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