Vitas-M small molecule compound

(2-chloro-5-nitrophenyl){4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl}methanone

Catalog ID
STK150237
SMILES Clc1ccc(cc1C(=O)N1CCN(CC1)c1ccc(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 C18H14ClF3N4O5 MW 458.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14ClF3N4O5/c19-14-3-2-12(25(28)29)10-13(14)17(27)24-7-5-23(6-8-24)15-4-1-11(18(20,21)22)9-16(15)26(30)31/h1-4,9-10H,5-8H2
InChIKey
UZRAGEHATKKUHQ-UHFFFAOYSA-N
Synonyms

(2CHLORO5NITROPHENYL)(4(2NITRO4(TRIFLUOROMETHYL)PHENYL)PIPERAZIN1YL)METHANONE
C1CN(CCN1C2=C(C=C(C=C2)C(F)(F)F)(N+)(=O)(O))C(=O)C3=C(C=CC(=C3)(N+)(=O)(O))Cl
Clc1ccc(cc1C(=O)N1CCN(CC1)c1ccc(cc1(N+)(=O)(O))C(F)(F)F)(N+)(=O)(O)
InChI=1SC18H14ClF3N4O5c19143212(25(28)29)1013(14)17(27)247523(6824)154111(18(2021)22)916(15)26(30)31h14910H58H2
MFCD03159258
ZINC000008846781
ZINC08846781
ZINC8846781

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Available files

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