Vitas-M small molecule compound

4'-chloro-1'-[4-cyclopropyl-6-(trifluoromethyl)pyrimidin-2-yl]-1,1'',5,5''-tetramethyl-1H,1'H,1''H-4,3':5',4''-terpyrazole

Catalog ID
STL413177
SMILES Cc1n(C)ncc1c1n(nc(c1Cl)c1cnn(c1C)C)c1nc(cc(n1)C(F)(F)F)C1CC1

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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 C21H20ClF3N8 MW 476.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20ClF3N8/c1-10-13(8-26-31(10)3)18-17(22)19(14-9-27-32(4)11(14)2)33(30-18)20-28-15(12-5-6-12)7-16(29-20)21(23,24)25/h7-9,12H,5-6H2,1-4H3
InChIKey
JKZLNZQZMULOIS-UHFFFAOYSA-N
Synonyms
1006356-46-2
1006356462
2(4chloro35bis(15dimethylpyrazol4yl)pyrazol1yl)4cyclopropyl6(trifluoromethyl)pyrimidine
4chloro1(4cyclopropyl6(trifluoromethyl)pyrimidin2yl)1155tetramethyl1H1H1H4354terpyrazole
CC1=C(C=NN1C)C2=C(C(=NN2C3=NC(=CC(=N3)C(F)(F)F)C4CC4)C5=C(N(N=C5)C)C)Cl
InChI=1SC21H20ClF3N8c11013(82631(10)3)1817(22)19(1492732(4)11(14)2)33(3018)202815(125612)716(2920)21(2324)25h7912H56H214H3
MFCD08553092
ZINC000013643502
ZINC13643502

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Available files

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