| SpectraBase Spectrum ID |
4qMwXXxjmXE |
| Name |
(2Z)-N-[4-(3-Bromoanilino)pyrido[3,4-d]pyrimidin-6-yl]-4-[(4-tert-butoxycarbonyl)piperazin-1-yl]2-butenamide |
| Appearance |
Light brown solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C26H30BrN7O3 |
| InChI |
InChI=1S/C26H30BrN7O3/c1-26(2,3)37-25(36)34-12-10-33(11-13-34)9-5-8-23(35)32-22-15-20-21(16-28-22)29-17-30-24(20)31-19-7-4-6-18(27)14-19/h4-8,14-17H,9-13H2,1-3H3,(H,28,32,35)(H,29,30,31)/b8-5- |
| InChIKey |
LNLMERHMEGAQRS-YVMONPNESA-N |
| Instrument Name |
JEOL JMS-700 MStation |
| Ionization Type |
EI positive ion |
| Literature Reference DOI |
10.1021/acsmedchemlett.6b00520 |
| Molecular Weight |
568.476 g/mol |
| Reported Formula |
C26H30BrN7O3 |
| SMILES |
N(C(\C=C/CN1CCN(C(OC(C)(C)C)=O)CC1)=O)c1cc2c(ncnc2cn1)Nc1cccc(Br)c1 |
| SPLASH |
splash10-001r-1009010000-74e8b1333c5fe718530c |
| Source of Spectrum |
MCS-8-SM3-2 |
| Wiley ID |
1870701 |
![(2Z)-N-[4-(3-Bromoanilino)pyrido[3,4-d]pyrimidin-6-yl]-4-[(4-tert-butoxycarbonyl)piperazin-1-yl]2-butenamide](/api/spectrum/4qMwXXxjmXE/structure.png?h=300&w=458 "(2Z)-N-[4-(3-Bromoanilino)pyrido[3,4-d]pyrimidin-6-yl]-4-[(4-tert-butoxycarbonyl)piperazin-1-yl]2-butenamide")
