Vitas-M small molecule compound
{4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazin-1-yl}[4-(propan-2-yloxy)phenyl]methanone
Catalog ID
STK205896
SMILES CC(Oc1ccc(cc1)C(=O)N1CCN(CC1)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-])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 C21H21F3N4O6 MW 482.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21F3N4O6/c1-13(2)34-16-5-3-14(4-6-16)20(29)26-9-7-25(8-10-26)19-17(27(30)31)11-15(21(22,23)24)12-18(19)28(32)33/h3-6,11-13H,7-10H2,1-2H3InChIKey
SNGJXWQSORQVQB-UHFFFAOYSA-NSynonyms
(4(26DINITRO4(TRIFLUOROMETHYL)PHENYL)PIPERAZIN1YL)(4(PROPAN2YLOXY)PHENYL)METHANONE
(4(26DINITRO4(TRIFLUOROMETHYL)PHENYL)PIPERAZIN1YL)(4PROPAN2YLOXYPHENYL)METHANONE
CC(C)OC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3(N+)(=O)(O))C(F)(F)F)(N+)(=O)(O)
CC(Oc1ccc(cc1)C(=O)N1CCN(CC1)c1c(cc(cc1(N+)(=O)(O))C(F)(F)F)(N+)(=O)(O))C
InChI=1SC21H21F3N4O6c113(2)34165314(4616)20(29)269725(81026)1917(27(30)31)1115(21(2223)24)1218(19)28(32)33h361113H710H212H3
MFCD05838566
ZINC000009971695
ZINC09971695
ZINC9971695
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