Vitas-M small molecule compound
N'-[(E)-{4-[(4-chlorobenzyl)oxy]-3-ethoxy-5-(prop-2-en-1-yl)phenyl}methylidene]-2-[2-nitro-4-(trifluoromethyl)phenyl]acetohydrazide
Catalog ID
STK011170
SMILES CCOc1cc(/C=N/NC(=O)Cc2ccc(cc2[N+](=O)[O-])C(F)(F)F)cc(c1OCc1ccc(cc1)Cl)CC=C
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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 C28H25ClF3N3O5 MW 575.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25ClF3N3O5/c1-3-5-21-12-19(13-25(39-4-2)27(21)40-17-18-6-10-23(29)11-7-18)16-33-34-26(36)14-20-8-9-22(28(30,31)32)15-24(20)35(37)38/h3,6-13,15-16H,1,4-5,14,17H2,2H3,(H,34,36)/b33-16+InChIKey
YEFDPQBJWRTKLF-MHDJOFBISA-NSynonyms
CCOC1=CC(=CC(=C1OCC2=CC=C(C=C2)Cl)CC=C)C=NNC(=O)CC3=C(C=C(C=C3)C(F)(F)F)(N+)(=O)(O)
CCOc1cc(C=NNC(=O)Cc2ccc(cc2(N+)(=O)(O))C(F)(F)F)cc(c1OCc1ccc(cc1)Cl)CC=C
InChI=1SC28H25ClF3N3O5c135211219(1325(3942)27(21)40171861023(29)11718)16333426(36)14208922(28(3031)32)1524(20)35(37)38h36131516H1451417H22H3(H3436)b3316+
MFCD02047038
N((E)(4((4CHLOROBENZYL)OXY)3ETHOXY5(PROP2EN1YL)PHENYL)METHYLIDENE)2(2NITRO4(TRIFLUOROMETHYL)PHENYL)ACETOHYDRAZIDE
N((E)(4((4chlorophenyl)methoxy)3ethoxy5prop2enylphenyl)methylideneamino)2(2nitro4(trifluoromethyl)phenyl)acetamide
STK011170
ZINC000006600415
ZINC100227739
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