Chem
J-GLOBAL ID:200907097859206887
Nikkaji number:J2.258.881H
TAK-242
TAK-242
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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:
C15 H17 ClFNO4 S
Molecular formula furigana:
C15-H17-CL-F-N-O4-S
Molecular weight:
361.810
InChI:
InChI=1S/C15H17ClFNO4S/c1-2-22-15(19)11-5-3-4-6-14(11)23(20,21)18-13-8-7-10(17)9-12(13)16/h5,7-9,14,18H,2-4,6H2,1H3/t14-/m1/s1
InChI key:
LEEIJTHMHDMWLJ-CQSZACIVSA-N
SMILES:
CCOC(=O)C1=CCCC[C@H]1S(=O)(=O)Nc1ccc(F)cc1Cl
Systematic name (4):
(6R)-6β-(2-クロロ-4-フルオロアニリノスルホニル)-1-シクロヘキセン-1-カルボン酸エチル
(6R)-6-[(2-クロロ-4-フルオロフェニル)スルファモイル]シクロヘキセン-1-カルボン酸エチル
エチル (6R)-6-[(2-クロロ-4-フルオロフェニル)スルファモイル]シクロヘキサ-1-エン-1-カルボキシラート
ethyl (6R)-6-[(2-chloro-4-fluorophenyl)sulfamoyl]cyclohex-1-ene-1-carboxylate
Other name (6):
(6R)-6β-(2-Chloro-4-fluoroanilinosulfonyl)-1-cyclohexene-1-carboxylic acid ethyl ester
TAK-242
(6R)-6-[(2-Chloro-4-fluorophenyl)sulfamoyl]cyclohexene-1-carboxylic acid ethyl ester
CLI-095
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CAS registry number:
243984-11-4
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