Vitas-M small molecule compound
{4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazin-1-yl}(4-methoxyphenyl)methanone
Catalog ID
STK150243
SMILES COc1ccc(cc1)C(=O)N1CCN(CC1)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]
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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 C19H17F3N4O6 MW 454.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17F3N4O6/c1-32-14-4-2-12(3-5-14)18(27)24-8-6-23(7-9-24)17-15(25(28)29)10-13(19(20,21)22)11-16(17)26(30)31/h2-5,10-11H,6-9H2,1H3InChIKey
HSUATZDGSCMEHE-UHFFFAOYSA-NSynonyms
(4(26DINITRO4(TRIFLUOROMETHYL)PHENYL)PIPERAZIN1YL)(4METHOXYPHENYL)METHANONE
1(26DINITRO4(TRIFLUOROMETHYL)PHENYL)4((4METHOXYPHENYL)CARBONYL)PIPERAZINE
COC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3(N+)(=O)(O))C(F)(F)F)(N+)(=O)(O)
COc1ccc(cc1)C(=O)N1CCN(CC1)c1c(cc(cc1(N+)(=O)(O))C(F)(F)F)(N+)(=O)(O)
InChI=1SC19H17F3N4O6c132144212(3514)18(27)248623(7924)1715(25(28)29)1013(19(2021)22)1116(17)26(30)31h251011H69H21H3
MFCD03159261
ZINC000009720436
ZINC09720436
ZINC9720436
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