Vitas-M small molecule compound

2-[4-bromo-3-(difluoromethyl)-5-methyl-1H-pyrazol-1-yl]-N-[1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)propyl]acetamide

Catalog ID
STL396802
SMILES CCC(C12CC3CC(C2)CC(C1)C3)NC(=O)Cn1nc(c(c1C)Br)C(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 C20H28BrF2N3O MW 444.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H28BrF2N3O/c1-3-15(20-7-12-4-13(8-20)6-14(5-12)9-20)24-16(27)10-26-11(2)17(21)18(25-26)19(22)23/h12-15,19H,3-10H2,1-2H3,(H,24,27)
InChIKey
ORQYYEHRXZBBEL-UHFFFAOYSA-N
Synonyms
1005603-03-1
1005603031
2(4bromo3(difluoromethyl)5methyl1Hpyrazol1yl)N(1(tricyclo(3311~37~)dec1yl)propyl)acetamide
CCC(C12CC3CC(C1)CC(C3)C2)NC(=O)CN4C(=C(C(=N4)C(F)F)Br)C
InChI=1SC20H28BrF2N3Oc1315(20712413(820)614(512)920)2416(27)102611(2)17(21)18(2526)19(22)23h121519H310H212H3(H2427)
N(1(1ADAMANTYL)PROPYL)2(4BROMO3(DIFLUOROMETHYL)5METHYLPYRAZOL1YL)ACETAMIDE
ZINC000019639947
ZINC000019639952

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Available files

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