Vitas-M small molecule compound

ethyl 1-{[5-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-3-yl]carbonyl}piperidine-3-carboxylate

Catalog ID
STK339871
SMILES CCOC(=O)C1CCCN(C1)C(=O)c1cnn2c1nc(cc2C(F)(F)F)c1cccs1

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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 C20H19F3N4O3S MW 452.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19F3N4O3S/c1-2-30-19(29)12-5-3-7-26(11-12)18(28)13-10-24-27-16(20(21,22)23)9-14(25-17(13)27)15-6-4-8-31-15/h4,6,8-10,12H,2-3,5,7,11H2,1H3
InChIKey
FMHWEWUYVNMQJD-UHFFFAOYSA-N
Synonyms
831188-88-6
831188886
CCOC(=O)C1CCCN(C1)C(=O)C2=C3N=C(C=C(N3N=C2)C(F)(F)F)C4=CC=CS4
ETHYL1((5(2THIENYL)7(TRIFLUOROMETHYL)8HYDROPYRAZOLO(15A)PYRIMIDIN3YL)CARBONYL)PIPERIDINE3CARBOXYLATE
ethyl1((5(thiophen2yl)7(trifluoromethyl)pyrazolo(15a)pyrimidin3yl)carbonyl)piperidine3carboxylate
ETHYL1(5THIOPHEN2YL7(TRIFLUOROMETHYL)PYRAZOLO(15A)PYRIMIDINE3CARBONYL)PIPERIDINE3CARBOXYLATE
InChI=1SC20H19F3N4O3Sc123019(29)1253726(1112)18(28)1310242716(20(2122)23)914(2517(13)27)156483115h4681012H235711H21H3
MFCD06625913
ZINC000001058827
ZINC000001058829

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.