Products 1381757-44-3

CAS 1381757-44-3 appears in our catalog under these names: Dabigatran Impurity 15, Dabigatran Etexilate Impurity K, Dabigatran Etexilate N-Oxide. Offered by: Hubei YoungXin, Chemat Brand. Available pack sizes: 10mg, 25mg, 50mg, 100mg, 200mg, on request.

Structural formula: {0} (CAS {1})

Ethyl 3-[[2-[[4-(N-hexoxycarbonylcarbamimidoyl)anilino]methyl]-1-methylbenzimidazole-5-carbonyl]-(1-oxidopyridin-1-ium-2-yl)amino]propanoate (CAS 1381757-44-3) is a chemical compound with the molecular formula C34H41N7O6 and a molecular weight of 643.7 g/mol. IUPAC name: ethyl 3-[[2-[[4-(N-hexoxycarbonylcarbamimidoyl)anilino]methyl]-1-methylbenzimidazole-5-carbonyl]-(1-oxidopyridin-1-ium-2-yl)amino]propanoate. InChIKey: ODWAOSMOSLZPGX-UHFFFAOYSA-N.

Identity
Molecular formulaC34H41N7O6
Molecular weight643.7 g/mol
IUPAC nameethyl 3-[[2-[[4-(N-hexoxycarbonylcarbamimidoyl)anilino]methyl]-1-methylbenzimidazole-5-carbonyl]-(1-oxidopyridin-1-ium-2-yl)amino]propanoate
InChIKeyODWAOSMOSLZPGX-UHFFFAOYSA-N
SMILESCCCCCCOC(=O)NC(=N)C1=CC=C(C=C1)NCC2=NC3=C(N2C)C=CC(=C3)C(=O)N(CCC(=O)OCC)C4=CC=CC=[N+]4[O-]

Computed by PubChem (NCBI)