Vitas-M small molecule compound
3-fluoro-4-({4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl}carbonyl)benzonitrile
Catalog ID
STK347317
SMILES N#Cc1ccc(c(c1)F)C(=O)N1CCN(CC1)c1ccc(cc1[N+](=O)[O-])C(F)(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 C19H14F4N4O3 MW 422.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H14F4N4O3/c20-15-9-12(11-24)1-3-14(15)18(28)26-7-5-25(6-8-26)16-4-2-13(19(21,22)23)10-17(16)27(29)30/h1-4,9-10H,5-8H2InChIKey
NHGDFKBTFXQYQY-UHFFFAOYSA-NSynonyms
5512-19-63fluoro4((4(2nitro4(trifluoromethyl)phenyl)piperazin1yl)carbonyl)benzonitrile
3FLUORO4(4(2NITRO4(TRIFLUOROMETHYL)PHENYL)PIPERAZINE1CARBONYL)BENZONITRILE
5512196
C1CN(CCN1C2=C(C=C(C=C2)C(F)(F)F)(N+)(=O)(O))C(=O)C3=C(C=C(C=C3)C#N)F
InChI=1SC19H14F4N4O3c2015912(1124)1314(15)18(28)267525(6826)164213(19(2122)23)1017(16)27(29)30h14910H58H2
MFCD06632549
N#Cc1ccc(c(c1)F)C(=O)N1CCN(CC1)c1ccc(cc1(N+)(=O)(O))C(F)(F)F
ZINC000012860780
ZINC12860780
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