Vitas-M small molecule compound

[3-chloro-5-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl](2-ethylpiperidin-1-yl)methanone

Catalog ID
STK838237
SMILES CCC1CCCCN1C(=O)c1nn2c(c1Cl)nc(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 C19H18ClF3N4OS MW 442.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18ClF3N4OS/c1-2-11-6-3-4-8-26(11)18(28)16-15(20)17-24-12(13-7-5-9-29-13)10-14(19(21,22)23)27(17)25-16/h5,7,9-11H,2-4,6,8H2,1H3
InChIKey
JLJRZKJHRJTXHG-UHFFFAOYSA-N
Synonyms

(3CHLORO5(THIOPHEN2YL)7(TRIFLUOROMETHYL)PYRAZOLO(15A)PYRIMIDIN2YL)((2R)2ETHYLPIPERIDIN1YL)METHANONE
(3chloro5(thiophen2yl)7(trifluoromethyl)pyrazolo(15a)pyrimidin2yl)(2ethylpiperidin1yl)methanone
(3CHLORO5THIOPHEN2YL7(TRIFLUOROMETHYL)PYRAZOLO(15A)PYRIMIDIN2YL)(2ETHYLPIPERIDIN1YL)METHANONE
3CHLORO2((2ETHYL1PIPERIDINYL)CARBONYL)5(2THIENYL)7(TRIFLUOROMETHYL)PYRAZOLO(15A)PYRIMIDINE
3CHLORO5(2THIENYL)7(TRIFLUOROMETHYL)(8HYDROPYRAZOLO(15A)PYRIMIDIN2YL)2ETHYLPIPERIDYLKETONE
CCC1CCCCN1C(=O)C2=NN3C(=CC(=NC3=C2Cl)C4=CC=CS4)C(F)(F)F
InChI=1SC19H18ClF3N4OSc1211634826(11)18(28)1615(20)172412(137592913)1014(19(2122)23)27(17)2516h57911H2468H21H3
MFCD01010065
ZINC000000829560
ZINC000001104367

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Available files

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