Chem
J-GLOBAL ID：200907013219785229   Nikkaji number：J524.977E

3-[Dibenzo[b,e]thiepin-11(6H)-ylidene]-N,N-dimethyl-1-propanamine

3-[ジベンゾ[b,e]チエピン-11(6H)-イリデン]-N,N-ジメチル-1-プロパンアミン
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： C19H21NS
Molecular formula furigana： C19-H21-N-S
Molecular weight： 295.440
InChI： InChI=1S/C19H21NS/c1-20(2)13-7-11-17-16-9-4-3-8-15(16)14-21-19-12-6-5-10-18(17)19/h3-6,8-12H,7,13-14H2,1-2H3
InChI key： PHTUQLWOUWZIMZ-UHFFFAOYSA-N
SMILES： CN(C)CCC=C1c2ccccc2CSc2ccccc12
Systematic name  (3)：
  • 3-[ジベンゾ[b,e]チエピン-11(6H)-イリデン]-N,N-ジメチル-1-プロパンアミン
  • ジメチル(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}プロピル)アミン
  • dimethyl(3-{9-thiatricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaen-2-ylidene}propyl)amine
Other name (1)：
  • 3-[Dibenzo[b,e]thiepin-11(6H)-ylidene]-N,N-dimethyl-1-propanamine
CAS registry number： 113-53-1
KEGG DRUG： D07872
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