| SpectraBase Spectrum ID |
6CHo9qvaool |
| Name |
5-[({[7-(2-chlorobenzyl)-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]sulfanyl}acetyl)amino]-2-phenyl-2H-1,2,3-triazole-4-carboxamide |
| Alternate Name(s) |
5-[2-[7-[(2-chlorophenyl)methyl]-1,3-dimethyl-2,6-bis(oxidanylidene)purin-8-yl]sulfanylethanoylamino]-2-phenyl-1,2,3-triazole-4-carboxamide
5-[[2-[7-[(2-chlorophenyl)methyl]-1,3-dimethyl-2,6-dioxo-purin-8-yl]sulfanylacetyl]amino]-2-phenyl-triazole-4-carboxamide
5-[[2-[[7-(2-chlorobenzyl)-2,6-diketo-1,3-dimethyl-purin-8-yl]thio]acetyl]amino]-2-phenyl-triazole-4-carboxamide
5-[[2-[[7-[(2-chlorophenyl)methyl]-1,3-dimethyl-2,6-dioxo-8-purinyl]thio]-1-oxoethyl]amino]-2-phenyl-4-triazolecarboxamide |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H22ClN9O4S |
| InChI |
InChI=1S/C25H22ClN9O4S/c1-32-22-19(23(38)33(2)25(32)39)34(12-14-8-6-7-11-16(14)26)24(29-22)40-13-17(36)28-21-18(20(27)37)30-35(31-21)15-9-4-3-5-10-15/h3-11H,12-13H2,1-2H3,(H2,27,37)(H,28,31,36) |
| InChIKey |
DBOGWXIYYBUWNS-UHFFFAOYSA-N |
| Molecular Weight |
580.023 g/mol |
| SMILES |
N(c1n[n](nc1C(=O)N)-c1ccccc1)C(CSc1nc2c([n]1Cc1c(Cl)cccc1)C(=O)N(C(N2C)=O)C)=O |
| SPLASH |
splash10-004i-9711000000-352cb7de1a58770ad6d1 |
| Wiley ID |
1464238 |
![5-[({[7-(2-chlorobenzyl)-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]sulfanyl}acetyl)amino]-2-phenyl-2H-1,2,3-triazole-4-carboxamide](/api/spectrum/6CHo9qvaool/structure.png?h=300&w=458 "5-[({[7-(2-chlorobenzyl)-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]sulfanyl}acetyl)amino]-2-phenyl-2H-1,2,3-triazole-4-carboxamide")
