For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Diethyl 7-amino-4,5-dihydro-2-methylthio-5-phenylpyrazolo[1,5-a]pyrimidine-3,6-dicarboxylate
SpectraBase Compound ID CF49KwyetuC
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
Mol Weight 402.47 g/mol
Molecular Formula C19H22N4O4S
Exact Mass 402.136176 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

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