Vitas-M small molecule compound
1-[4-(1-ethyl-1H-pyrazol-4-yl)-6-(trifluoromethyl)pyrimidin-2-yl]azepane
Catalog ID
STL413043
SMILES CCn1ncc(c1)c1nc(nc(c1)C(F)(F)F)N1CCCCCC1
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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 C16H20F3N5 MW 339.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20F3N5/c1-2-24-11-12(10-20-24)13-9-14(16(17,18)19)22-15(21-13)23-7-5-3-4-6-8-23/h9-11H,2-8H2,1H3InChIKey
NSEQRYQMVCCOTG-UHFFFAOYSA-NSynonyms
1174887-26-31(4(1ethyl1Hpyrazol4yl)6(trifluoromethyl)pyrimidin2yl)azepane
1(4(1ethylpyrazol4yl)6(trifluoromethyl)pyrimidin2yl)azepane
1174887263
CCN1C=C(C=N1)C2=CC(=NC(=N2)N3CCCCCC3)C(F)(F)F
InChI=1SC16H20F3N5c12241112(102024)13914(16(1718)19)2215(2113)2375346823h911H28H21H3
MFCD09475250
ZINC000036618641
ZINC36618641
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