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Substance Name: Hexanoic acid, 6-(11-(methylthio)-5H-pyrido(4,3-c)(1)benzazepin-5-ylidene)-
RN: 127654-12-0
InChIKey: QKTCHWICXVEBCE-AUWJEWJLSA-N
Classification Code
- Drug / Therapeutic Agent
Molecular Formula
- C20-H20-N2-O2-S
Molecular Weight
- 352.456
Names and Synonyms
Synonyms
- 5-(5-Carboxypentylidene)-11-thiomethyl-5H-pyrido(3,4-c)(1)benzazepin
- 6-(11-(Methylthio)-5H-pyrido(4,3-c)(1)benzazepin-5-ylidene)hexanoic acid
Systematic Name
- Hexanoic acid, 6-(11-(methylthio)-5H-pyrido(4,3-c)(1)benzazepin-5-ylidene)-
Registry Numbers
CAS Registry Number
- 127654-12-0
System Generated Number
- 0127654120
Structure Descriptors
InChI
1S/C20H20N2O2S/c1-25-20-17-13-21-12-11-15(17)14(7-3-2-4-10-19(23)24)16-8-5-6-9-18(16)22-20/h5-9,11-13H,2-4,10H2,1H3,(H,23,24)/b14-7-InChIKey
QKTCHWICXVEBCE-AUWJEWJLSA-NSmiles
CSC1=Nc2ccccc2/C(=C\CCCCC(=O)Toxicity
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD | intraperitoneal | > 100mg/kg (100mg/kg) | United States Patent Document. Vol. #4971964, | |
mouse | LD | oral | > 300mg/kg (300mg/kg) | United States Patent Document. Vol. #4971964, |