Vitas-M small molecule compound
1-(3-fluoro-4-methylphenyl)-3-[1-(tricyclo[3.3.1.1~3,7~]dec-1-yl)propyl]urea
Catalog ID
STK479200
SMILES CCC(C12CC3CC(C2)CC(C1)C3)NC(=O)Nc1ccc(c(c1)F)C
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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 C21H29FN2O MW 344.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H29FN2O/c1-3-19(21-10-14-6-15(11-21)8-16(7-14)12-21)24-20(25)23-17-5-4-13(2)18(22)9-17/h4-5,9,14-16,19H,3,6-8,10-12H2,1-2H3,(H2,23,24,25)InChIKey
KLTLEARHVXFVBC-UHFFFAOYSA-NSynonyms
1(1(1adamantyl)propyl)3(3fluoro4methylphenyl)urea
1(3fluoro4methylphenyl)3(1(tricyclo(3311~37~)dec1yl)propyl)urea
CCC(C12CC3CC(C1)CC(C3)C2)NC(=O)NC4=CC(=C(C=C4)C)F
InChI=1SC21H29FN2Oc1319(211014615(1121)816(714)1221)2420(25)23175413(2)18(22)917h459141619H3681012H212H3(H2232425)
ZINC000013320287
ZINC000013320288
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