1H-1,4-Benzodiazepine-7-carbonitrile, 2,3-dihydro-1-methyl-2-oxo-5-phenyl-

CAS 3489-59-6 MFCD03489596

化学结构图

3489-59-6
SMILES: CN1C(=O)CN=C(c2ccccc2)c2cc(C#N)ccc21

化学属性

Mol. FormulaC17H13N3O
Mol. Weight275.33

别名和识别编码

Wiswesser Line NotationT67 GNV JN IHJ CCN G1 KR
Chemical Name1H-1,4-Benzodiazepine-7-carbonitrile, 2,3-dihydro-1-methyl-2-oxo-5-phenyl-
Synonym 2,3-Dihydro-1-methyl-2-oxo-5-phenyl-1H-1,4-benzodiazepine-7-carbonitrile Ro 5-4528
CAS Number3489-59-6
Beilstein Registry Number0757698
InChIKeyPMDUNHOOULGNCQ-UHFFFAOYSA-N
PubChem Substance ID19011
InChIInChI=1S/C17H13N3O/c1-20-15-8-7-12(10-18)9-14(15)17(19-11-16(20)21)13-5-3-2-4-6-13/h2-9H,11H2,1H3
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安全信息

RTECSDE8746500 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 290 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   AIPTAK Archives Internationales de Pharmacodynamie et de Therapie. (Heymans
   Institute of Pharmacology, De Pintelaan 185, B-9000 Ghent, Belgium)  V.4-   
   1898-  Volume(issue)/page/year: 154,131,1965

系列性分类

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