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* Service & Products of Interested: [Isotope Labeled Impurities] Deacetamidine Cyano Dabigatran Ethyl Ester-[d3] (1346597-93-0)
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Deacetamidine Cyano Dabigatran Ethyl Ester-[d3]

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General Information
Catalog: BLP-002452
CAS: 1346597-93-0
Molecular Formula: C27H23D3N6O3
Molecular Weight: 485.55

Chemical Structure

Description	Deacetamidine Cyano Dabigatran Ethyl Ester-[d3], is the labelled analogue of Deacetamidine Cyano Dabigatran Ethyl Ester, which is an intermediate of Nonpeptide thrombin inhibitor.
Synonyms	Deacetamidine Cyano Dabigatran-d3 Ethyl Ester
IUPAC Name	ethyl 3-[[2-[(4-cyanoanilino)methyl]-1-(trideuteriomethyl)benzimidazole-5-carbonyl]-pyridin-2-ylamino]propanoate
Related CAS	211915-84-3 (unlabelled)
Canonical SMILES	CCOC(=O)CCN(C1=CC=CC=N1)C(=O)C2=CC3=C(C=C2)N(C(=N3)CNC4=CC=C(C=C4)C#N)C
InChI	InChI=1S/C27H26N6O3/c1-3-36-26(34)13-15-33(24-6-4-5-14-29-24)27(35)20-9-12-23-22(16-20)31-25(32(23)2)18-30-21-10-7-19(17-28)8-11-21/h4-12,14,16,30H,3,13,15,18H2,1-2H3/i2D3
InChI Key	OZBOESGNDSVMDK-BMSJAHLVSA-N
Boiling Point	756.4±60.0 °C at 760 mmHg
Density	1.3±0.1 g/cm3
Solubility	Soluble in Chloroform, Methanol
Appearance	White Solid
Storage	Store at 2-8°C