Vitas-M small molecule compound
(2E)-3-(2,4-dichlorophenyl)-N-(2-{[4-nitro-2-(trifluoromethyl)phenyl]amino}ethyl)prop-2-enamide
Catalog ID
STK013075
SMILES O=C(/C=C/c1ccc(cc1Cl)Cl)NCCNc1ccc(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 C18H14Cl2F3N3O3 MW 448.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14Cl2F3N3O3/c19-12-3-1-11(15(20)9-12)2-6-17(27)25-8-7-24-16-5-4-13(26(28)29)10-14(16)18(21,22)23/h1-6,9-10,24H,7-8H2,(H,25,27)/b6-2+InChIKey
HBUXQXCMNIDYFF-QHHAFSJGSA-NSynonyms
(2E)3(24DICHLOROPHENYL)N(2((4NITRO2(TRIFLUOROMETHYL)PHENYL)AMINO)ETHYL)PROP2ENAMIDE
(E)3(24DICHLOROPHENYL)N(2(4NITRO2(TRIFLUOROMETHYL)ANILINO)ETHYL)PROP2ENAMIDE
C1=CC(=C(C=C1(N+)(=O)(O))C(F)(F)F)NCCNC(=O)C=CC2=C(C=C(C=C2)Cl)Cl
InChI=1SC18H14Cl2F3N3O3c19123111(15(20)912)2617(27)258724165413(26(28)29)1014(16)18(2122)23h1691024H78H2(H2527)b62+
MFCD02627899
O=C(C=Cc1ccc(cc1Cl)Cl)NCCNc1ccc(cc1C(F)(F)F)(N+)(=O)(O)
STK013075
ZINC000008816344
ZINC08816344
ZINC8816344
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