Vitas-M small molecule compound
azepan-1-yl[5-(5-chlorothiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl]methanone
Catalog ID
STK449726
SMILES Clc1ccc(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 C18H16ClF3N4OS MW 428.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16ClF3N4OS/c19-15-6-5-13(28-15)11-9-14(18(20,21)22)26-16(23-11)10-12(24-26)17(27)25-7-3-1-2-4-8-25/h5-6,9-10H,1-4,7-8H2InChIKey
YIUUENPBOSLOTG-UHFFFAOYSA-NSynonyms
2(1AZEPANYLCARBONYL)5(5CHLORO2THIENYL)7(TRIFLUOROMETHYL)PYRAZOLO(15A)PYRIMIDINE
AZAPERHYDROEPINYL5(5CHLORO(2THIENYL))7(TRIFLUOROMETHYL)(8HYDROPYRAZOLO(15A)PYRIMIDIN2YL)KETONE
azepan1yl(5(5chlorothiophen2yl)7(trifluoromethyl)pyrazolo(15a)pyrimidin2yl)methanone
C1CCCN(CC1)C(=O)C2=NN3C(=CC(=NC3=C2)C4=CC=C(S4)Cl)C(F)(F)F
InChI=1SC18H16ClF3N4OSc19156513(2815)11914(18(2021)22)2616(2311)1012(2426)17(27)2573124825h56910H1478H2
MFCD03468220
ZINC000000653800
ZINC00653800
ZINC653800
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