DABIGATRAN ETEXILATE ,872728-81-9 _Chemical Cloud Database

DABIGATRAN ETEXILATE

Basic Information
Product Name：	DABIGATRAN ETEXILATE
CAS：	872728-81-9 ;211915-06-9 ;593282-20-3
English Synonyms：	BIBR 953 ; PRAZAXA ; PRADAXA ; N-[2-[4-[N-(HEXYLOXYCARBONYL)AMIDINO]PHENYLAMINOMETHYL]-1-METHYL-1H-BENZIMIDAZOL-5-YLCARBONYL]-N-(2-PYRIDYL)-BETA-ALANINE ETHYL ESTER ; DABIGATRAN ETEXILATE (MESYLATE) ; (E)-HEXYL 2-(4-((5-((3-ETHOXY-3-OXOPROPYL)(PYRIDIN-2-YL)CARBAMOYL)-1-METHYL-1H-BENZO[D]IMIDAZOL-2-YL)METHYLAMINO)BENZYLIDENE)HYDRAZINECARBOXYLATE METHANESULFONATE ; DABIGATRAN ETEXILATE ; DABIGATRAN
MDL Number.：	MFCD16038312
H bond acceptor：	12
H bond donor：	2
Smile：	CCCCCCOC(=O)/N=C(/c1ccc(cc1)NCc2nc3cc(ccc3n2C)C(=O)N(CCC(=O)OCC)c4ccccn4)\N
InChi：	InChI=1S/C34H41N7O5/c1-4-6-7-10-21-46-34(44)39-32(35)24-12-15-26(16-13-24)37-23-30-38-27-22-25(14-17-28(27)40(30)3)33(43)41(20-18-31(42)45-5-2)29-11-8-9-19-36-29/h8-9,11-17,19,22,37H,4-7,10,18,20-21,23H2,1-3H3,(H2,35,39,44)
InChiKey：	InChIKey=KSGXQBZTULBEEQ-UHFFFAOYSA-N
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