Vitas-M small molecule compound
(2E)-3-(4-chlorophenyl)-1-{4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazin-1-yl}prop-2-en-1-one
Catalog ID
STK150445
SMILES Clc1ccc(cc1)/C=C/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 C20H16ClF3N4O5 MW 484.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16ClF3N4O5/c21-15-4-1-13(2-5-15)3-6-18(29)25-7-9-26(10-8-25)19-16(27(30)31)11-14(20(22,23)24)12-17(19)28(32)33/h1-6,11-12H,7-10H2/b6-3+InChIKey
IQDUOZCTAQLYFC-ZZXKWVIFSA-NSynonyms
(2E)3(4CHLOROPHENYL)1(4(26DINITRO4(TRIFLUOROMETHYL)PHENYL)PIPERAZIN1YL)PROP2EN1ONE
(E)3(4CHLOROPHENYL)1(4(26DINITRO4(TRIFLUOROMETHYL)PHENYL)PIPERAZIN1YL)PROP2EN1ONE
C1CN(CCN1C2=C(C=C(C=C2(N+)(=O)(O))C(F)(F)F)(N+)(=O)(O))C(=O)C=CC3=CC=C(C=C3)Cl
Clc1ccc(cc1)C=CC(=O)N1CCN(CC1)c1c(cc(cc1(N+)(=O)(O))C(F)(F)F)(N+)(=O)(O)
InChI=1SC20H16ClF3N4O5c21154113(2515)3618(29)257926(10825)1916(27(30)31)1114(20(2223)24)1217(19)28(32)33h161112H710H2b63+
MFCD03614887
ZINC000009721011
ZINC09721011
ZINC9721011
Check stock
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