| SpectraBase Spectrum ID |
9V7qZXVC5oQ |
| Name |
Acetamide, N-benzyl-2-(8-chloro-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydropurin-7-yl)- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
361.094167092 u |
| Formula |
C16H16ClN5O3 |
| InChI |
InChI=1S/C16H16ClN5O3/c1-20-13-12(14(24)21(2)16(20)25)22(15(17)19-13)9-11(23)18-8-10-6-4-3-5-7-10/h3-7H,8-9H2,1-2H3,(H,18,23) |
| InChIKey |
WVDUMBRSLZQIPL-UHFFFAOYSA-N |
| Molecular Weight |
361.789 g/mol |
| SMILES |
C12=C(N(CC(NCC3=CC=CC=C3)=O)C(=N1)Cl)C(=O)N(C(N2C)=O)C |
