Vitas-M small molecule compound
azepan-1-yl[5-(5-ethylthiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl]methanone
Catalog ID
STK449599
SMILES CCc1ccc(s1)c1nc2cc(nn2c(c1)C(F)(F)F)C(=O)N1CCCCCC1
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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 C20H21F3N4OS MW 422.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21F3N4OS/c1-2-13-7-8-16(29-13)14-11-17(20(21,22)23)27-18(24-14)12-15(25-27)19(28)26-9-5-3-4-6-10-26/h7-8,11-12H,2-6,9-10H2,1H3InChIKey
BUJIPHJUYNHEGH-UHFFFAOYSA-NSynonyms
AZAPERHYDROEPINYL5(5ETHYL(2THIENYL))7(TRIFLUOROMETHYL)(8HYDROPYRAZOLO(15A)PYRIMIDIN2YL)KETONE
azepan1yl(5(5ethylthiophen2yl)7(trifluoromethyl)pyrazolo(15a)pyrimidin2yl)methanone
CCC1=CC=C(S1)C2=NC3=CC(=NN3C(=C2)C(F)(F)F)C(=O)N4CCCCCC4
InChI=1SC20H21F3N4OSc12137816(2913)141117(20(2122)23)2718(2414)1215(2527)19(28)26953461026h781112H26910H21H3
MFCD03467904
ZINC000000654163
ZINC00654163
ZINC654163
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