| SpectraBase Spectrum ID |
AIqeWjnyzkX |
| Name |
Ethyl N-[5-(cyanoacetyl)-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl]-3-(1-naphthyl)alaninate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
448.174669884 u |
| Formula |
C24H24N4O5 |
| InChI |
InChI=1S/C24H24N4O5/c1-4-33-23(31)18(14-16-10-7-9-15-8-5-6-11-17(15)16)26-21-20(19(29)12-13-25)22(30)28(3)24(32)27(21)2/h5-11,18,26H,4,12,14H2,1-3H3 |
| InChIKey |
ZMKSITIVPCSKAT-UHFFFAOYSA-N |
| Molecular Weight |
448.479 g/mol |
| SMILES |
C=1(N(C(=O)N(C(C1C(=O)CC#N)=O)C)C)NC(C(=O)OCC)CC1=C2C(C=CC=C2)=CC=C1 |
![Ethyl N-[5-(cyanoacetyl)-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl]-3-(1-naphthyl)alaninate](/api/spectrum/AIqeWjnyzkX/structure.png?h=300&w=458 "Ethyl N-[5-(cyanoacetyl)-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl]-3-(1-naphthyl)alaninate")
