Chem
J-GLOBAL ID:200907086378033839
Nikkaji number:J257.420I
3-[Dibenzo[b,e]thiepin-11(6H)-ylidene]-8-methyl-8-azabicyclo[3.2.1]octane
3-[ジベンゾ[b,e]チエピン-11(6H)-イリデン]-8-メチル-8-アザビシクロ[3.2.1]オクタン
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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:
C22 H23 NS
Molecular formula furigana:
C22-H23-N-S
Molecular weight:
333.490
InChI:
InChI=1S/C22H23NS/c1-23-17-10-11-18(23)13-16(12-17)22-19-7-3-2-6-15(19)14-24-21-9-5-4-8-20(21)22/h2-9,17-18H,10-14H2,1H3
InChI key:
JOQKFRLFXDPXHX-UHFFFAOYSA-N
SMILES:
CN1C2CCC1C/C(=C\1/c3ccccc3CSc3ccccc13)/C2
Systematic name (3):
3-[ジベンゾ[b,e]チエピン-11(6H)-イリデン]-8-メチル-8-アザビシクロ[3.2.1]オクタン
8-メチル-3-{9-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-2-イリデン}-8-アザビシクロ[3.2.1]オクタン
8-methyl-3-{9-thiatricyclo[9.4.0.03,8 ]pentadeca-1(15),3,5,7,11,13-hexaen-2-ylidene}-8-azabicyclo[3.2.1]octane
Other name (1):
3-[Dibenzo[b,e]thiepin-11(6H)-ylidene]-8-methyl-8-azabicyclo[3.2.1]octane
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