| SpectraBase Spectrum ID |
J0alXgdmI18 |
| Name |
(S)-METHYL-6-(3-CYANO-5-METHYLPYRAZOLO-[1,5-A]-PYRIMIDIN-7-YLAMINO)-2-(2-FLUORO-4-NITROBENZAMIDE)-HEXANOATE |
| Compound Number |
14 |
| Copyright |
Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula |
C22H22FN7O5 |
| InChI |
InChI=1S/C22H22FN7O5/c1-13-9-19(29-20(27-13)14(11-24)12-26-29)25-8-4-3-5-18(22(32)35-2)28-21(31)16-7-6-15(30(33)34)10-17(16)23/h6-7,9-10,12,18,25H,3-5,8H2,1-2H3,(H,28,31)/t18-/m0/s1 |
| InChIKey |
VJUSROKVMFGGRI-SFHVURJKSA-N |
| Literature Reference Author |
J.XU,H.LIU,Y.HE,R.DING,X.WANG,M.FENG,S.ZHANG,Y.CHEN,S.LI,M.Z
HAO,Y.LI,C.QI,Y.DANG |
| Literature Reference Citation |
MOLECULES,17,3774(2012) |
| Literature Reference DOI |
10.3390/molecules17043774 |
| Molecular Weight |
483.459 g/mol |
| Sample ID |
1848 |
| Solvent |
CDCl3 |
![(S)-METHYL-6-(3-CYANO-5-METHYLPYRAZOLO-[1,5-A]-PYRIMIDIN-7-YLAMINO)-2-(2-FLUORO-4-NITROBENZAMIDE)-HEXANOATE](/api/spectrum/J0alXgdmI18/structure.png?h=300&w=458 "(S)-METHYL-6-(3-CYANO-5-METHYLPYRAZOLO-[1,5-A]-PYRIMIDIN-7-YLAMINO)-2-(2-FLUORO-4-NITROBENZAMIDE)-HEXANOATE")
