| SpectraBase Spectrum ID |
167gVsiUIC |
| Name |
N-(5-isopropyl-1,3,4-thiadiazol-2-yl)-3-[3-methyl-2,6-dioxo-4-(trifluoromethyl)pyrimidin-1-yl]benzamide |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
439.092595055 u |
| Formula |
C18H16F3N5O3S |
| InChI |
InChI=1S/C18H16F3N5O3S/c1-9(2)15-23-24-16(30-15)22-14(28)10-5-4-6-11(7-10)26-13(27)8-12(18(19,20)21)25(3)17(26)29/h4-9H,1-3H3,(H,22,24,28) |
| InChIKey |
PDNCTNCSMFZNFB-UHFFFAOYSA-N |
| Instrument Name |
Finnigan TRACE |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/jhet.2160 |
| Molecular Weight |
439.413 g/mol |
| Quality |
36 |
| SMILES |
N(C(C1=CC(N2C(N(C(=CC2=O)C(F)(F)F)C)=O)=CC=C1)=O)C1=NN=C(S1)C(C)C |
| SPLASH |
splash10-0002-1890000000-9d9ff4fbf1a0cf2b607d |
| Source of Spectrum |
Y-52-1311-8g (DOI: 10.1002/jhet.2160) |
| Wiley ID |
1902499 |
![N-(5-isopropyl-1,3,4-thiadiazol-2-yl)-3-[3-methyl-2,6-dioxo-4-(trifluoromethyl)pyrimidin-1-yl]benzamide](/api/spectrum/167gVsiUIC/structure.png?h=300&w=458 "N-(5-isopropyl-1,3,4-thiadiazol-2-yl)-3-[3-methyl-2,6-dioxo-4-(trifluoromethyl)pyrimidin-1-yl]benzamide")
