Vitas-M small molecule compound
ethyl 2-[7-tert-butyl-3-(trifluoromethyl)-4,5,6,7-tetrahydro-2H-indazol-2-yl]-1,3-thiazole-4-carboxylate
Catalog ID
STL442121
SMILES CCOC(=O)c1csc(n1)n1nc2c(c1C(F)(F)F)CCCC2C(C)(C)C
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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 C18H22F3N3O2S MW 401.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22F3N3O2S/c1-5-26-15(25)12-9-27-16(22-12)24-14(18(19,20)21)10-7-6-8-11(13(10)23-24)17(2,3)4/h9,11H,5-8H2,1-4H3InChIKey
ZACHNGHMCSEJFG-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CSC(=N1)N2C(=C3CCCC(C3=N2)C(C)(C)C)C(F)(F)F
ethyl2(7tertbutyl3(trifluoromethyl)4567tetrahydro2Hindazol2yl)13thiazole4carboxylate
ethyl2(7tertbutyl3(trifluoromethyl)4567tetrahydroindazol2yl)13thiazole4carboxylate
InChI=1SC18H22F3N3O2Sc152615(25)1292716(2212)2414(18(1920)21)1076811(13(10)2324)17(23)4h911H58H214H3
MFCD09992838
ZINC000033436054
ZINC000033436055
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