Chem
J-GLOBAL ID:200907070451961878
Nikkaji number:J310.827I
4-[3-[(Z)-2-Chloro-9H-thioxanthen-9-ylidene]propyl]-1-piperazineethanol acetate
4-[3-[(Z)-2-クロロ-9H-チオキサンテン-9-イリデン]プロピル]-1-ピペラジンエタノールアセタート
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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:
C24 H27 ClN2 O2 S
Molecular formula furigana:
C24-H27-CL-N2-O2-S
Molecular weight:
443.000
InChI:
InChI=1S/C24H27ClN2O2S/c1-18(28)29-16-15-27-13-11-26(12-14-27)10-4-6-20-21-5-2-3-7-23(21)30-24-9-8-19(25)17-22(20)24/h2-3,5-9,17H,4,10-16H2,1H3/b20-6-
InChI key:
OXAUOBQMCDIVPQ-IOXNKQMXSA-N
SMILES:
CC(=O)OCCN1CCN(CC/C=C\2/c3ccccc3Sc3ccc(Cl)cc23)CC1
Systematic name (3):
4-[3-[(Z)-2-クロロ-9H-チオキサンテン-9-イリデン]プロピル]-1-ピペラジンエタノールアセタート
2-(4-{3-[(9Z)-2-クロロ-9H-チオキサンテン-9-イリデン]プロピル}ピペラジン-1-イル)エチル アセタート
2-(4-{3-[(9Z)-2-chloro-9H-thioxanthen-9-ylidene]propyl}piperazin-1-yl)ethyl acetate
Other name (1):
4-[3-[(Z)-2-Chloro-9H-thioxanthen-9-ylidene]propyl]-1-piperazineethanol acetate
CAS registry number:
85721-05-7
Regulation number (1):
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