Vitas-M small molecule compound

ethyl 2-[5-hydroxy-3-(naphthalen-2-yl)-5-(1,1,2,2-tetrafluoroethyl)-4,5-dihydro-1H-pyrazol-1-yl]-1,3-thiazole-4-carboxylate

Catalog ID
STL439582
SMILES CCOC(=O)c1csc(n1)N1N=C(CC1(O)C(C(F)F)(F)F)c1ccc2c(c1)cccc2

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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 C21H17F4N3O3S MW 467.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17F4N3O3S/c1-2-31-17(29)16-11-32-19(26-16)28-20(30,21(24,25)18(22)23)10-15(27-28)14-8-7-12-5-3-4-6-13(12)9-14/h3-9,11,18,30H,2,10H2,1H3
InChIKey
GLYJZTRVZIQETC-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=CSC(=N1)N2C(CC(=N2)C3=CC4=CC=CC=C4C=C3)(C(C(F)F)(F)F)O
ethyl2(5hydroxy3(naphthalen2yl)5(1122tetrafluoroethyl)45dihydro1Hpyrazol1yl)13thiazole4carboxylate
ethyl2(5hydroxy3naphthalen2yl5(1122tetrafluoroethyl)4Hpyrazol1yl)13thiazole4carboxylate
InChI=1SC21H17F4N3O3Sc123117(29)16113219(2616)2820(3021(2425)18(22)23)1015(2728)148712534613(12)914h39111830H210H21H3
MFCD06241437
ZINC000008750729
ZINC000016949765

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Available files

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