Vitas-M small molecule compound

N-[1-(pentafluorobenzyl)-1H-pyrazol-3-yl]tricyclo[3.3.1.1~3,7~]decane-1-carboxamide

Catalog ID
STK304013
SMILES O=C(C12CC3CC(C2)CC(C1)C3)Nc1ccn(n1)Cc1c(F)c(F)c(c(c1F)F)F

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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 C21H20F5N3O MW 425.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20F5N3O/c22-15-13(16(23)18(25)19(26)17(15)24)9-29-2-1-14(28-29)27-20(30)21-6-10-3-11(7-21)5-12(4-10)8-21/h1-2,10-12H,3-9H2,(H,27,28,30)
InChIKey
BAGDEVYEUDZQTK-UHFFFAOYSA-N
Synonyms
1005696-71-8
1005696718
C1C2CC3CC1CC(C2)(C3)C(=O)NC4=NN(C=C4)CC5=C(C(=C(C(=C5F)F)F)F)F
InChI=1SC21H20F5N3Oc221513(16(23)18(25)19(26)17(15)24)9292114(2829)2720(30)21610311(721)512(410)821h121012H39H2(H272830)
MFCD04044006
N(1((23456pentafluorophenyl)methyl)pyrazol3yl)adamantane1carboxamide
N(1(pentafluorobenzyl)1Hpyrazol3yl)tricyclo(3311~37~)decane1carboxamide
ZINC000008782435
ZINC08782435
ZINC8782435

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Available files

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