| SpectraBase Spectrum ID |
FFTULxKcsLh |
| Name |
N-[3-Chloro-4-(4-morpholinyl)phenyl]-2-[(1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]acetamide |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
478.119002115 u |
| Formula |
C20H23ClN6O4S |
| InChI |
InChI=1S/C20H23ClN6O4S/c1-24-16-17(25(2)20(30)26(3)18(16)29)23-19(24)32-11-15(28)22-12-4-5-14(13(21)10-12)27-6-8-31-9-7-27/h4-5,10H,6-9,11H2,1-3H3,(H,22,28) |
| InChIKey |
XWPIWPSIMSAYOL-UHFFFAOYSA-N |
| Molecular Weight |
478.955 g/mol |
| SMILES |
N(C(CSC1=NC2=C(C(=O)N(C(N2C)=O)C)N1C)=O)C=1C=C(Cl)C(=CC1)N1CCOCC1 |
![N-[3-chloro-4-(4-morpholinyl)phenyl]-2-[(1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]acetamide](/api/spectrum/FFTULxKcsLh/structure.png?h=300&w=458 "N-[3-chloro-4-(4-morpholinyl)phenyl]-2-[(1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]acetamide")
