Vitas-M small molecule compound
methyl 2-[3-(2,4-dimethoxyphenyl)-5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-1,3-thiazole-4-carboxylate
Catalog ID
STL439966
SMILES COc1ccc(c(c1)OC)C1=NN(C(C1)(O)C(F)(F)F)c1scc(n1)C(=O)OC
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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 C17H16F3N3O5S MW 431.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16F3N3O5S/c1-26-9-4-5-10(13(6-9)27-2)11-7-16(25,17(18,19)20)23(22-11)15-21-12(8-29-15)14(24)28-3/h4-6,8,25H,7H2,1-3H3InChIKey
WIYJQIUGIDCJDS-UHFFFAOYSA-NSynonyms
COC1=CC(=C(C=C1)C2=NN(C(C2)(C(F)(F)F)O)C3=NC(=CS3)C(=O)OC)OC
InChI=1SC17H16F3N3O5Sc12694510(13(69)272)11716(2517(1819)20)23(2211)152112(82915)14(24)283h46825H7H213H3
methyl2(3(24dimethoxyphenyl)5hydroxy5(trifluoromethyl)45dihydro1Hpyrazol1yl)13thiazole4carboxylate
METHYL2(3(24DIMETHOXYPHENYL)5HYDROXY5(TRIFLUOROMETHYL)4HPYRAZOL1YL)13THIAZOLE4CARBOXYLATE
MFCD06241464
ZINC000008753839
ZINC000008753843
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