| SpectraBase Spectrum ID |
2QKxRRqZLc |
| Name |
Ethyl 7-hydroxy-7-chloromethyl-5-(4-methoxyphenyl)-2-benzylthio-4,5,6,7-tetrahydro-1,2,4-triazolo[1.5-a]pyrimidine-6-carboxylate |
| Alternate Name(s) |
7-(chloromethyl)-7-hydroxy-5-(4-methoxyphenyl)-2-(phenylmethylthio)-5,6-dihydro-1H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid ethyl ester
Ethyl 2-benzylsulfanyl-7-(chloromethyl)-7-hydroxy-5-(4-methoxyphenyl)-5,6-dihydro-1H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Ethyl 7-(chloromethyl)-5-(4-methoxyphenyl)-7-oxidanyl-2-(phenylmethylsulfanyl)-5,6-dihydro-1H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H25ClN4O4S |
| InChI |
InChI=1S/C23H25ClN4O4S/c1-3-32-20(29)18-19(16-9-11-17(31-2)12-10-16)25-21-26-22(27-28(21)23(18,30)14-24)33-13-15-7-5-4-6-8-15/h4-12,18-19,30H,3,13-14H2,1-2H3,(H,25,26,27) |
| InChIKey |
SGCAEZROTFYUNH-UHFFFAOYSA-N |
| Molecular Weight |
488.990 g/mol |
| SMILES |
N1C(C(C([n]2c1nc(n2)SCc1ccccc1)(O)CCl)C(=O)OCC)c1ccc(cc1)OC |
| SPLASH |
splash10-001l-5790000000-f3e4fe3f3cb85f2fc4f4 |
| Source of Spectrum |
Y-46-147-6m |
| Wiley ID |
1666692 |
![Ethyl 7-hydroxy-7-chloromethyl-5-(4-methoxyphenyl)-2-benzylthio-4,5,6,7-tetrahydro-1,2,4-triazolo[1.5-a]pyrimidine-6-carboxylate](/api/spectrum/2QKxRRqZLc/structure.png?h=300&w=458 "Ethyl 7-hydroxy-7-chloromethyl-5-(4-methoxyphenyl)-2-benzylthio-4,5,6,7-tetrahydro-1,2,4-triazolo[1.5-a]pyrimidine-6-carboxylate")
