Chem
J-GLOBAL ID:200907033418581684
Nikkaji number:J78.106A
(-)-Clothepin
(-)-クロテピン
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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:
C19 H21 ClN2 S
Molecular formula furigana:
C19-H21-CL-N2-S
Molecular weight:
344.900
InChI:
InChI=1S/C19H21ClN2S/c1-21-8-10-22(11-9-21)17-12-14-4-2-3-5-18(14)23-19-7-6-15(20)13-16(17)19/h2-7,13,17H,8-12H2,1H3/t17-/m1/s1
InChI key:
XRYLGRGAWQSVQW-QGZVFWFLSA-N
SMILES:
CN1CCN(CC1)[C@@H]1Cc2ccccc2Sc2ccc(Cl)cc12
Systematic name (4):
(10R)-8-クロロ-10,11-ジヒドロ-10α-(4-メチル-1-ピペラジニル)ジベンゾ[b,f]チエピン
[R,(-)]-8-クロロ-10-(4-メチルピペラジノ)-10,11-ジヒドロジベンゾ[b,f]チエピン
1-[(9R)-6-クロロ-2-チアトリシクロ[9.4.0.03,8 ]ペンタデカ-1(15),3,5,7,11,13-ヘキサエン-9-イル]-4-メチルピペラジン
1-[(9R)-6-chloro-2-thiatricyclo[9.4.0.03,8 ]pentadeca-1(15),3,5,7,11,13-hexaen-9-yl]-4-methylpiperazine
Other name (10):
(-)-オクトクロテピン
(-)-クロロテピン
(-)-クロテピン
(-)-Octoclothepin
(-)-Clothepin
(-)-Clorotepine
(-)-Octoclothepine
[R,(-)]-8-Chloro-10-(4-methylpiperazino)-10,11-dihydrodibenzo[b,f]thiepin
(R)-オクトクロテピン
(R)-Octoclothepin
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CAS registry number:
41931-05-9
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