Vitas-M small molecule compound
2,2-dimethyl-N-{4-[4-(pentafluorophenyl)piperazin-1-yl]phenyl}propanamide
Catalog ID
STK389474
SMILES O=C(C(C)(C)C)Nc1ccc(cc1)N1CCN(CC1)c1c(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 C21H22F5N3O MW 427.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22F5N3O/c1-21(2,3)20(30)27-12-4-6-13(7-5-12)28-8-10-29(11-9-28)19-17(25)15(23)14(22)16(24)18(19)26/h4-7H,8-11H2,1-3H3,(H,27,30)InChIKey
UBXINILVZFNEBT-UHFFFAOYSA-NSynonyms
22dimethylN(4(4(23456pentafluorophenyl)piperazin1yl)phenyl)propanamide
22dimethylN(4(4(pentafluorophenyl)piperazin1yl)phenyl)propanamide
CC(C)(C)C(=O)NC1=CC=C(C=C1)N2CCN(CC2)C3=C(C(=C(C(=C3F)F)F)F)F
InChI=1SC21H22F5N3Oc121(23)20(30)27124613(7512)2881029(11928)1917(25)15(23)14(22)16(24)18(19)26h47H811H213H3(H2730)
MFCD03836102
ZINC000004122004
ZINC04122004
ZINC4122004
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