Vitas-M small molecule compound
ethyl 4-{[5-(5-ethylthiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl]carbonyl}piperazine-1-carboxylate
Catalog ID
STK306750
SMILES CCOC(=O)N1CCN(CC1)C(=O)c1cc2n(n1)c(cc(n2)c1ccc(s1)CC)C(F)(F)F
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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 C21H22F3N5O3S MW 481.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22F3N5O3S/c1-3-13-5-6-16(33-13)14-11-17(21(22,23)24)29-18(25-14)12-15(26-29)19(30)27-7-9-28(10-8-27)20(31)32-4-2/h5-6,11-12H,3-4,7-10H2,1-2H3InChIKey
QQYJWFXYCXHTCE-UHFFFAOYSA-NSynonyms
828284-18-0828284180
CCC1=CC=C(S1)C2=NC3=CC(=NN3C(=C2)C(F)(F)F)C(=O)N4CCN(CC4)C(=O)OCC
ethyl4((5(5ethylthiophen2yl)7(trifluoromethyl)pyrazolo(15a)pyrimidin2yl)carbonyl)piperazine1carboxylate
ethyl4(5(5ethylthiophen2yl)7(trifluoromethyl)pyrazolo(15a)pyrimidine2carbonyl)piperazine1carboxylate
InChI=1SC21H22F3N5O3Sc13135616(3313)141117(21(2223)24)2918(2514)1215(2629)19(30)277928(10827)20(31)3242h561112H34710H212H3
MFCD04056467
ZINC000002791727
ZINC02791727
ZINC2791727
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