| SpectraBase Spectrum ID |
4U4RzhKusZC |
| Name |
2-Butylamino-8-cyano-3-(4-fluorophenyl)-5-methyl-7-(methylthio)-pyrido[4,3-D]pyrimidin-4(3H)-one |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
397.137259620 u |
| Formula |
C20H20FN5OS |
| InChI |
InChI=1S/C20H20FN5OS/c1-4-5-10-23-20-25-17-15(11-22)18(28-3)24-12(2)16(17)19(27)26(20)14-8-6-13(21)7-9-14/h6-9H,4-5,10H2,1-3H3,(H,23,25) |
| InChIKey |
UUDDZXQCISGIQJ-UHFFFAOYSA-N |
| Molecular Weight |
397.472 g/mol |
| SMILES |
C=1(N(C(C2=C(N1)C(=C(N=C2C)SC)C#N)=O)C1=CC=C(C=C1)F)NCCCC |
![2-Butylamino-8-cyano-3-(4-fluorophenyl)-5-methyl-7-(methylthio)-pyrido[4,3-d]pyrimidin-4(3H)-one](/api/spectrum/4U4RzhKusZC/structure.png?h=300&w=458 "2-Butylamino-8-cyano-3-(4-fluorophenyl)-5-methyl-7-(methylthio)-pyrido[4,3-d]pyrimidin-4(3H)-one")
