Vitas-M small molecule compound
ethyl 2-{[3-(4-chlorophenyl)-2,5-dimethylpyrazolo[1,5-a]pyrimidin-7-yl]sulfanyl}-3-oxobutanoate
Catalog ID
STK741543
SMILES CCOC(=O)C(C(=O)C)Sc1cc(C)nc2n1nc(c2c1ccc(cc1)Cl)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C20H20ClN3O3S MW 417.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20ClN3O3S/c1-5-27-20(26)18(13(4)25)28-16-10-11(2)22-19-17(12(3)23-24(16)19)14-6-8-15(21)9-7-14/h6-10,18H,5H2,1-4H3InChIKey
XUQPKCWBSIOIRS-UHFFFAOYSA-NSynonyms
877784-10-6877784106
CCOC(=O)C(C(=O)C)SC1=CC(=NC2=C(C(=NN12)C)C3=CC=C(C=C3)Cl)C
ethyl2((3(4chlorophenyl)25dimethylpyrazolo(15a)pyrimidin7yl)sulfanyl)3oxobutanoate
ethyl2((3(4chlorophenyl)25dimethylpyrazolo(15a)pyrimidin7yl)thio)3oxobutanoate
ETHYL2(3(4CHLOROPHENYL)25DIMETHYL(8HYDROPYRAZOLO(15A)PYRIMIDIN7YLTHIO))3OXOBUTANOATE
ETHYL2(3(4CHLOROPHENYL)25DIMETHYLPYRAZOLO(15A)PYRIMIDIN7YL)SULFANYL3OXOBUTANOATE
InChI=1SC20H20ClN3O3Sc152720(26)18(13(4)25)28161011(2)221917(12(3)2324(16)19)146815(21)9714h61018H5H214H3
MFCD05700929
ZINC000005561909
ZINC000005561913
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