Catalog Number:
AG008R6C
Chemical Name:
(R)-3-(4-(7H-Pyrrolo[2,3-d]pyrimidin-4-yl)-1h-pyrazol-1-yl)-3-cyclopentylpropanenitrile phosphate
CAS Number:
1092939-17-7
Molecular Formula:
C17H21N6O4P
Molecular Weight:
404.3602
MDL Number:
MFCD18452860
IUPAC Name:
(3R)-3-cyclopentyl-3-[4-(7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrazol-1-yl]propanenitrile;phosphoric acid
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
InChI Key:
JFMWPOCYMYGEDM-XFULWGLBSA-N
SMILES:
OP(=O)(O)O.N#CC[C@@H](n1ncc(c1)c1ncnc2c1cc[nH]2)C1CCCC1
UNII:
436LRU32H5
