| SpectraBase Spectrum ID |
GD0iliQ195 |
| Name |
Ethyl 7-hydroxy-7-chloromethyl-5-(4-methylphenyl)-2-methylthio-4,5,6,7-tetrahydro-1,2,4-triazolo[1.5-a]pyrimidine-6-carboxylate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H21ClN4O3S |
| InChI |
InChI=1S/C17H21ClN4O3S/c1-4-25-14(23)12-13(11-7-5-10(2)6-8-11)19-15-20-16(26-3)21-22(15)17(12,24)9-18/h5-8,12-13,24H,4,9H2,1-3H3,(H,19,20,21) |
| InChIKey |
VSHLQFBHUOGCFH-UHFFFAOYSA-N |
| Molecular Weight |
396.893 g/mol |
| SMILES |
N1C(C(C([n]2c1nc(n2)SC)(O)CCl)C(=O)OCC)c1ccc(cc1)C |
| SPLASH |
splash10-00lr-0690000000-1283158cff4a9a625d46 |
| Source of Spectrum |
Y-46-147-6i |
| Synonyms |
7-(chloromethyl)-7-hydroxy-5-(4-methylphenyl)-2-(methylthio)-5,6-dihydro-1H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid ethyl ester
Ethyl 7-(chloromethyl)-7-hydroxy-5-(4-methylphenyl)-2-methylsulfanyl-5,6-dihydro-1H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Ethyl 7-(chloromethyl)-7-hydroxy-2-methylsulfanyl-5-(p-tolyl)-5,6-dihydro-1H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate
Ethyl 7-(chloromethyl)-5-(4-methylphenyl)-2-methylsulfanyl-7-oxidanyl-5,6-dihydro-1H-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate |
| Wiley ID |
1666693 |
![Ethyl 7-hydroxy-7-chloromethyl-5-(4-methylphenyl)-2-methylthio-4,5,6,7-tetrahydro-1,2,4-triazolo[1.5-a]pyrimidine-6-carboxylate](/api/spectrum/GD0iliQ195/structure.png?h=300&w=458 "Ethyl 7-hydroxy-7-chloromethyl-5-(4-methylphenyl)-2-methylthio-4,5,6,7-tetrahydro-1,2,4-triazolo[1.5-a]pyrimidine-6-carboxylate")
