Vitas-M small molecule compound
(2E)-3-(4-chlorophenyl)-1-{4-[4-nitro-2-(trifluoromethyl)phenyl]piperazin-1-yl}prop-2-en-1-one
Catalog ID
STK157680
SMILES Clc1ccc(cc1)/C=C/C(=O)N1CCN(CC1)c1ccc(cc1C(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 C20H17ClF3N3O3 MW 439.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17ClF3N3O3/c21-15-4-1-14(2-5-15)3-8-19(28)26-11-9-25(10-12-26)18-7-6-16(27(29)30)13-17(18)20(22,23)24/h1-8,13H,9-12H2/b8-3+InChIKey
SBFWGHNUZGYYAC-FPYGCLRLSA-NSynonyms
642430-40-8(2E)3(4CHLOROPHENYL)1(4(4NITRO2(TRIFLUOROMETHYL)PHENYL)PIPERAZIN1YL)PROP2EN1ONE
(E)3(4CHLOROPHENYL)1(4(4NITRO2(TRIFLUOROMETHYL)PHENYL)PIPERAZIN1YL)PROP2EN1ONE
642430408
C1CN(CCN1C2=C(C=C(C=C2)(N+)(=O)(O))C(F)(F)F)C(=O)C=CC3=CC=C(C=C3)Cl
Clc1ccc(cc1)C=CC(=O)N1CCN(CC1)c1ccc(cc1C(F)(F)F)(N+)(=O)(O)
InChI=1SC20H17ClF3N3O3c21154114(2515)3819(28)2611925(101226)187616(27(29)30)1317(18)20(2223)24h1813H912H2b83+
MFCD03695254
ZINC000008995714
ZINC08995714
ZINC8995714
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