| SpectraBase Spectrum ID |
LGBUZTdvpFg |
| Name |
2-(9-methyl-4-oxo-7-phenyl-3H-pyrido[2,3]thieno[2,4-b]pyrimidin-2-yl)-3-oxo-pentanedinitrile |
| Appearance |
Wine-red powder |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H13N5O2S |
| InChI |
InChI=1S/C21H13N5O2S/c1-11-9-14(12-5-3-2-4-6-12)24-21-16(11)17-18(29-21)20(28)26-19(25-17)13(10-23)15(27)7-8-22/h2-6,9,13H,7H2,1H3,(H,25,26,28) |
| InChIKey |
BAPCLEZVZMCYLM-UHFFFAOYSA-N |
| Instrument Name |
Shimadzu GCMS-QP1000EX |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/jhet.3709 |
| Molecular Weight |
399.428 g/mol |
| SMILES |
N1C(c2sc3c(c2N=C1C(C#N)C(=O)CC#N)c(cc(n3)-c1ccccc1)C)=O |
| SPLASH |
splash10-0007-9500000000-32723679f64c6de53134 |
| Source of Spectrum |
Y-56-SM45-14 |
| Wiley ID |
1861124 |
![2-(9-methyl-4-oxo-7-phenyl-3H-pyrido[2,3]thieno[2,4-b]pyrimidin-2-yl)-3-oxo-pentanedinitrile](/api/spectrum/LGBUZTdvpFg/structure.png?h=300&w=458 "2-(9-methyl-4-oxo-7-phenyl-3H-pyrido[2,3]thieno[2,4-b]pyrimidin-2-yl)-3-oxo-pentanedinitrile")
