| SpectraBase Spectrum ID |
JtZSCrVs2i6 |
| Name |
1H-purine-2,6-dione, 7-[(2,4-dichlorophenyl)methyl]-3,7-dihydro-1,3-dimethyl-8-[[1-[(4-nitrophenyl)methyl]-1H-benzimidazol-2-yl]thio]- |
| Copyright |
Copyright © 2022-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
621.075278754 u |
| Formula |
C28H21Cl2N7O4S |
| InChI |
InChI=1S/C28H21Cl2N7O4S/c1-33-24-23(25(38)34(2)28(33)39)36(15-17-9-10-18(29)13-20(17)30)27(32-24)42-26-31-21-5-3-4-6-22(21)35(26)14-16-7-11-19(12-8-16)37(40)41/h3-13H,14-15H2,1-2H3 |
| InChIKey |
AOYDXJMRDDMXOM-UHFFFAOYSA-N |
| Molecular Weight |
622.487 g/mol |
| NMR Offset |
17.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_8582 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10210246; Lab Info: LP; Lab Number: LP-3701138 |
![1H-purine-2,6-dione, 7-[(2,4-dichlorophenyl)methyl]-3,7-dihydro-1,3-dimethyl-8-[[1-[(4-nitrophenyl)methyl]-1H-benzimidazol-2-yl]thio]-](/api/spectrum/JtZSCrVs2i6/structure.png?h=300&w=458 "1H-purine-2,6-dione, 7-[(2,4-dichlorophenyl)methyl]-3,7-dihydro-1,3-dimethyl-8-[[1-[(4-nitrophenyl)methyl]-1H-benzimidazol-2-yl]thio]-")
