API0232509

Ruxolitinib Phosphate

Rufinamide is an anticonvulsant drug.

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Molecular Weight (g/mol)

404.4
Molecular Formula

C17H21N6O4P
InChI

InChI=1S/C17H18N6.H3O4P/c18-7-5-15(12-3-1-2-4-12)23-10-13(9-22-23)16-14-6-8-19-17(14)21-11-20-16;1-5(2,3)4/h6,8-12,15H,1-5H2,(H,19,20,21);(H3,1,2,3,4)/t15-;/m1./s1
InChIKey

JFMWPOCYMYGEDM-XFULWGLBSA-N
SMILES

C1CCC(C1)[C@@H](CC#N)N2C=C(C=N2)C3=C4C=CNC4=NC=N3.OP(=O)(O)O
IUPAC Name

(3R)-3-cyclopentyl-3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrazol-1-yl]propanenitrile;phosphoric acid
Exact Mass (Da)

404.13619017
Monoisotopic Mass (Da)

404.13619017

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