SpectraBase Spectrum ID |
4re1RBioZoF |
Name |
Diethyl 7-amino-4,5-dihydro-2-methylthio-5-phenylpyrazolo[1,5-a]pyrimidine-3,6-dicarboxylate |
Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C19H22N4O4S |
InChI |
InChI=1S/C19H22N4O4S/c1-4-26-18(24)12-14(11-9-7-6-8-10-11)21-16-13(19(25)27-5-2)17(28-3)22-23(16)15(12)20/h6-10,14,21H,4-5,20H2,1-3H3 |
InChIKey |
MSDMBAVLEFYJGE-UHFFFAOYSA-N |
Literature Reference DOI |
10.1002/jccs.200100017 |
Molecular Weight |
402.469 g/mol |
SMILES |
N1C(C(=C([n]2c1c(c(n2)SC)C(=O)OCC)N)C(=O)OCC)c1ccccc1 |
SPLASH |
splash10-004i-2791000000-74d644c726fe4646f72f |
Source of Spectrum |
QA-48-96-11b |
Synonyms |
Diethyl 7-amino-2-(methylthio)-5-phenyl-4,5-dihydropyrazolo[1,5-a]pyrimidine-3,6-dicarboxylate |
Wiley ID |
1795256 |