| SpectraBase Spectrum ID |
CKWuIrrVSVd |
| Name |
N-(2,4-Difluorophenyl)-2-[(7-ethyl-1,3-dimethyl-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 |
409.102016924 u |
| Formula |
C17H17F2N5O3S |
| InChI |
InChI=1S/C17H17F2N5O3S/c1-4-24-13-14(22(2)17(27)23(3)15(13)26)21-16(24)28-8-12(25)20-11-6-5-9(18)7-10(11)19/h5-7H,4,8H2,1-3H3,(H,20,25) |
| InChIKey |
LDTLSFSDCZALMT-UHFFFAOYSA-N |
| Molecular Weight |
409.412 g/mol |
| SMILES |
N(C(CSC1=NC2=C(C(=O)N(C(N2C)=O)C)N1CC)=O)C1=C(C=C(C=C1)F)F |
![N-(2,4-difluorophenyl)-2-[(7-ethyl-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]acetamide](/api/spectrum/CKWuIrrVSVd/structure.png?h=300&w=458 "N-(2,4-difluorophenyl)-2-[(7-ethyl-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]acetamide")
