| SpectraBase Spectrum ID |
8LoKsrOnbJU |
| Name |
1H-Purine-2,6-dione, 7-[(2-chlorophenyl)methyl]-8-[[2-(diethylamino)ethyl]amino]-3,7-dihydro-1,3-dimethyl- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
418.188401831 u |
| Formula |
C20H27ClN6O2 |
| InChI |
InChI=1S/C20H27ClN6O2/c1-5-26(6-2)12-11-22-19-23-17-16(18(28)25(4)20(29)24(17)3)27(19)13-14-9-7-8-10-15(14)21/h7-10H,5-6,11-13H2,1-4H3,(H,22,23) |
| InChIKey |
ATDITNCMZRPWLH-UHFFFAOYSA-N |
| Molecular Weight |
418.929 g/mol |
| SMILES |
N(C1=NC2=C(N1CC=1C(Cl)=CC=CC1)C(=O)N(C(N2C)=O)C)CCN(CC)CC |
![1H-purine-2,6-dione, 7-[(2-chlorophenyl)methyl]-8-[[2-(diethylamino)ethyl]amino]-3,7-dihydro-1,3-dimethyl-](/api/spectrum/8LoKsrOnbJU/structure.png?h=300&w=458 "1H-purine-2,6-dione, 7-[(2-chlorophenyl)methyl]-8-[[2-(diethylamino)ethyl]amino]-3,7-dihydro-1,3-dimethyl-")
