Vitas-M small molecule compound
ethyl 2-[5-hydroxy-3-(3-hydroxyphenyl)-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]-1,3-thiazole-4-carboxylate
Catalog ID
STL438446
SMILES CCOC(=O)c1csc(n1)N1N=C(CC1(O)C(F)(F)F)c1cccc(c1)O
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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 C16H14F3N3O4S MW 401.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14F3N3O4S/c1-2-26-13(24)12-8-27-14(20-12)22-15(25,16(17,18)19)7-11(21-22)9-4-3-5-10(23)6-9/h3-6,8,23,25H,2,7H2,1H3InChIKey
CWVINXVAMQWEFR-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CSC(=N1)N2C(CC(=N2)C3=CC(=CC=C3)O)(C(F)(F)F)O
ethyl2(5hydroxy3(3hydroxyphenyl)5(trifluoromethyl)45dihydro1Hpyrazol1yl)13thiazole4carboxylate
ETHYL2(5HYDROXY3(3HYDROXYPHENYL)5(TRIFLUOROMETHYL)4HPYRAZOL1YL)13THIAZOLE4CARBOXYLATE
InChI=1SC16H14F3N3O4Sc122613(24)1282714(2012)2215(2516(1718)19)711(2122)943510(23)69h3682325H27H21H3
MFCD06241859
ZINC000004478290
ZINC000004478291
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