Vitas-M small molecule compound

ethyl 4-{[5-(thiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-3-yl]carbonyl}piperazine-1-carboxylate

Catalog ID
STK339853
SMILES CCOC(=O)N1CCN(CC1)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 C19H18F3N5O3S MW 453.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18F3N5O3S/c1-2-30-18(29)26-7-5-25(6-8-26)17(28)12-11-23-27-15(19(20,21)22)10-13(24-16(12)27)14-4-3-9-31-14/h3-4,9-11H,2,5-8H2,1H3
InChIKey
LSXZLFJUZIPCBC-UHFFFAOYSA-N
Synonyms
831236-66-9
831236669
CCOC(=O)N1CCN(CC1)C(=O)C2=C3N=C(C=C(N3N=C2)C(F)(F)F)C4=CC=CS4
ETHYL4((5(2THIENYL)7(TRIFLUOROMETHYL)8HYDROPYRAZOLO(15A)PYRIMIDIN3YL)CARBONYL)PIPERAZINECARBOXYLATE
ETHYL4((5(2THIENYL)7(TRIFLUOROMETHYL)PYRAZOLO(15A)PYRIMIDIN3YL)CARBONYL)1PIPERAZINECARBOXYLATE
ethyl4((5(thiophen2yl)7(trifluoromethyl)pyrazolo(15a)pyrimidin3yl)carbonyl)piperazine1carboxylate
ETHYL4(5THIOPHEN2YL7(TRIFLUOROMETHYL)PYRAZOLO(15A)PYRIMIDINE3CARBONYL)PIPERAZINE1CARBOXYLATE
InChI=1SC19H18F3N5O3Sc123018(29)267525(6826)17(28)1211232715(19(2021)22)1013(2416(12)27)144393114h34911H258H21H3
MFCD06626947
ZINC000001062775
ZINC01062775
ZINC1062775

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Available files

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