Chem
J-GLOBAL ID:200907019424806202
Nikkaji number:J1.861.050G
CI-1041
6-[2-[4-(4-フルオロベンジル)ピペリジノ]エチルスルフィニル]-2,3-ジヒドロベンゾオキサゾール-2-オン
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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:
C21 H23 FN2 O3 S
Molecular formula furigana:
C21-H23-F-N2-O3-S
Molecular weight:
402.480
InChI:
InChI=1S/C21H23FN2O3S/c22-17-3-1-15(2-4-17)13-16-7-9-24(10-8-16)11-12-28(26)18-5-6-19-20(14-18)27-21(25)23-19/h1-6,14,16H,7-13H2,(H,23,25)
InChI key:
FCBQJNCAKZSIAH-UHFFFAOYSA-N
SMILES:
Fc1ccc(CC2CCN(CCS(=O)c3ccc4[nH]c(=O)oc4c3)CC2)cc1
Systematic name (3):
6-[2-[4-(4-フルオロベンジル)ピペリジノ]エチルスルフィニル]-2,3-ジヒドロベンゾオキサゾール-2-オン
6-(2-{4-[(4-フルオロフェニル)メチル]ピペリジン-1-イル}エタンスルフィニル)-2,3-ジヒドロ-1,3-ベンゾオキサゾール-2-オン
6-(2-{4-[(4-fluorophenyl)methyl]piperidin-1-yl}ethanesulfinyl)-2,3-dihydro-1,3-benzoxazol-2-one
Other name (2):
6-[2-[4-(4-Fluorobenzyl)piperidino]ethylsulfinyl]-2,3-dihydrobenzoxazole-2-one
CI-1041
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