Vitas-M small molecule compound

3-{[5-tert-butyl-3-(4-chlorophenyl)-2-methylpyrazolo[1,5-a]pyrimidin-7-yl]sulfanyl}pentane-2,4-dione

Catalog ID
STK595146
SMILES CC(=O)C(C(=O)C)Sc1cc(nc2n1nc(c2c1ccc(cc1)Cl)C)C(C)(C)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 C22H24ClN3O2S MW 429.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24ClN3O2S/c1-12-19(15-7-9-16(23)10-8-15)21-24-17(22(4,5)6)11-18(26(21)25-12)29-20(13(2)27)14(3)28/h7-11,20H,1-6H3
InChIKey
ZZKJGCRZBXCEBG-UHFFFAOYSA-N
Synonyms
849912-52-3
3((5(tertbutyl)3(4chlorophenyl)2methylpyrazolo(15a)pyrimidin7yl)thio)pentane24dione
3((5tertbutyl3(4chlorophenyl)2methylpyrazolo(15a)pyrimidin7yl)sulfanyl)pentane24dione
3(5(TERTBUTYL)3(4CHLOROPHENYL)2METHYL8HYDROPYRAZOLO(15A)PYRIMIDIN7YLTHIO)PENTANE24DIONE
3(5TERTBUTYL3(4CHLOROPHENYL)2METHYLPYRAZOLO(15A)PYRIMIDIN7YL)SULFANYLPENTANE24DIONE
849912523
CC1=NN2C(=CC(=NC2=C1C3=CC=C(C=C3)Cl)C(C)(C)C)SC(C(=O)C)C(=O)C
InChI=1SC22H24ClN3O2Sc11219(157916(23)10815)212417(22(45)6)1118(26(21)2512)2920(13(2)27)14(3)28h71120H16H3
MFCD05688631
ZINC000101158423
ZINC101158423

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Available files

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