Chem
J-GLOBAL ID:200907060816288137
Nikkaji number:J2.612.557J
1-Methyl-4-fluoro-5-(phenylthio)-1H-pyrazole-3-carboxylic acid ethyl ester
1-メチル-4-フルオロ-5-(フェニルチオ)-1H-ピラゾール-3-カルボン酸エチル
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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:
C13 H13 FN2 O2 S
Molecular formula furigana:
C13-H13-F-N2-O2-S
Molecular weight:
280.320
InChI:
InChI=1S/C13H13FN2O2S/c1-3-18-13(17)11-10(14)12(16(2)15-11)19-9-7-5-4-6-8-9/h4-8H,3H2,1-2H3
InChI key:
VPNJEFXAMTYJHN-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1nn(C)c(Sc2ccccc2)c1F
Systematic name (3):
1-メチル-4-フルオロ-5-(フェニルチオ)-1H-ピラゾール-3-カルボン酸エチル
エチル 4-フルオロ-1-メチル-5-(フェニルスルファニル)-1H-ピラゾール-3-カルボキシラート
ethyl 4-fluoro-1-methyl-5-(phenylsulfanyl)-1H-pyrazole-3-carboxylate
Other name (1):
1-Methyl-4-fluoro-5-(phenylthio)-1H-pyrazole-3-carboxylic acid ethyl ester
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