| SpectraBase Spectrum ID |
21lFZeBJNQm |
| Name |
5-[4-(2-FLUOROETHYL)-4-METHYL-2-THIOXO-1,4-DIHYDRO-2-H-BENZO-[D]-[1.3]-OXAZIN-6-YL]-1-H-PYRROLE-2-CARBONITRILE |
| Compound Number |
17 |
| Copyright |
Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula |
C16H14FN3OS |
| InChI |
InChI=1S/C16H14FN3OS/c1-16(6-7-17)12-8-10(13-5-3-11(9-18)19-13)2-4-14(12)20-15(22)21-16/h2-5,8,19H,6-7H2,1H3,(H,20,22) |
| InChIKey |
CMHPNYIPLWOFGJ-UHFFFAOYSA-N |
| Literature Reference Author |
H.B.ZHOU,J.H.LEE,C.G.MAYNE,K.E.CARLSON,J.A.KATZENELLENBOGEN |
| Literature Reference Citation |
J.MED.CHEM.,53,3349(2010) |
| Literature Reference DOI |
10.1021/jm100052k |
| Solvent |
ACETONE-D6 |
| Source File Reference |
UWMZ46393 |
![5-[4-(2-FLUOROETHYL)-4-METHYL-2-THIOXO-1,4-DIHYDRO-2-H-BENZO-[D]-[1.3]-OXAZIN-6-YL]-1-H-PYRROLE-2-CARBONITRILE](/api/spectrum/21lFZeBJNQm/structure.png?h=300&w=458 "5-[4-(2-FLUOROETHYL)-4-METHYL-2-THIOXO-1,4-DIHYDRO-2-H-BENZO-[D]-[1.3]-OXAZIN-6-YL]-1-H-PYRROLE-2-CARBONITRILE")
