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Raltegravir-[13C,d3]

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Raltegravir-[13C,d3]

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General Information
Catalog: BLP-005979
Molecular Formula: C19[13C]H18FN6O5D3
Molecular Weight: 448.43

Chemical Structure

Description	An isotope labelled Raltegravir. Raltegravir is an integrase inhibitor as an antiretroviral drug. It can be used for the treatment of HIV infection.
Synonyms	N-[(4-Fluorophenyl)methyl]-1,6-dihydro-5-hydroxy-1-methyl-2-[1-methyl-1-[[(5-methyl-1,3,4-oxadiazol-2-yl)carbonyl]amino]ethyl]-6-oxo-4-pyrimidinecarboxamide-13C,d3
IUPAC Name	N-[2-[4-[(4-fluorophenyl)methylcarbamoyl]-5-hydroxy-6-oxo-1-(trideuterio(1-13C)methyl)pyrimidin-2-yl]propan-2-yl]-5-methyl-1,3,4-oxadiazole-2-carboxamide
Related CAS	518048-05-0 (unlabelled)
Canonical SMILES	CC1=NN=C(O1)C(=O)NC(C)(C)C2=NC(=C(C(=O)N2C)O)C(=O)NCC3=CC=C(C=C3)F
InChI	InChI=1S/C20H21FN6O5/c1-10-25-26-17(32-10)16(30)24-20(2,3)19-23-13(14(28)18(31)27(19)4)15(29)22-9-11-5-7-12(21)8-6-11/h5-8,28H,9H2,1-4H3,(H,22,29)(H,24,30)/i4+1D3
InChI Key	CZFFBEXEKNGXKS-JGWVFYFMSA-N
Purity	95% by HPLC; 98% atom D;98% atom 13C