| SpectraBase Spectrum ID |
KxOgJBN6CmV |
| Name |
1'-(Ethoxycarbonyl)ethyl 2-[5''-(methoxycarbonyl)-6H-1{'',3''-thiazin-2''-yl]-2-phthalimidopropanoate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
476.125336907 u |
| Formula |
C22H24N2O8S |
| InChI |
InChI=1S/C22H24N2O8S/c1-4-31-16(25)9-10-32-21(29)22(2,20-23-11-13(12-33-20)19(28)30-3)24-17(26)14-7-5-6-8-15(14)18(24)27/h5-8,11,20,23H,4,9-10,12H2,1-3H3 |
| InChIKey |
MNKJHHLPGGXJRR-UHFFFAOYSA-N |
| Molecular Weight |
476.500 g/mol |
| SMILES |
C1(N(C(C=2C=CC=CC12)=O)C(C1NC=C(CS1)C(=O)OC)(C(=O)OCCC(=O)OCC)C)=O |
![1'-(Ethoxycarbonyl)ethyl 2-[5"-(methoxycarbonyl)-6H-1{",3"-thiazin-2"-yl]-2-phthalimidopropanoate](/api/spectrum/KxOgJBN6CmV/structure.png?h=300&w=458 "1'-(Ethoxycarbonyl)ethyl 2-[5\"-(methoxycarbonyl)-6H-1{\",3\"-thiazin-2\"-yl]-2-phthalimidopropanoate")
