Vitas-M small molecule compound

N'-[(E)-(5-bromo-2-{[3-(trifluoromethyl)benzyl]oxy}phenyl)methylidene]-5-methylthiophene-3-carbohydrazide

Catalog ID
STK465648
SMILES Brc1ccc(c(c1)/C=N/NC(=O)c1csc(c1)C)OCc1cccc(c1)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 C21H16BrF3N2O2S MW 497.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16BrF3N2O2S/c1-13-7-16(12-30-13)20(28)27-26-10-15-9-18(22)5-6-19(15)29-11-14-3-2-4-17(8-14)21(23,24)25/h2-10,12H,11H2,1H3,(H,27,28)/b26-10+
InChIKey
RHZXNRJAHSCHHW-NSKAYECMSA-N
Synonyms

Brc1ccc(c(c1)C=NNC(=O)c1csc(c1)C)OCc1cccc(c1)C(F)(F)F
CC1=CC(=CS1)C(=O)NN=CC2=C(C=CC(=C2)Br)OCC3=CC(=CC=C3)C(F)(F)F
InChI=1SC21H16BrF3N2O2Sc113716(123013)20(28)27261015918(22)5619(15)29111432417(814)21(2324)25h21012H11H21H3(H2728)b2610+
MFCD06759295
N((1E)2(5BROMO2((3(TRIFLUOROMETHYL)PHENYL)METHOXY)PHENYL)1AZAVINYL)(5METHYL(3THIENYL))CARBOXAMIDE
N((E)(5bromo2((3(trifluoromethyl)benzyl)oxy)phenyl)methylidene)5methylthiophene3carbohydrazide
N((E)(5bromo2((3(trifluoromethyl)phenyl)methoxy)phenyl)methylideneamino)5methylthiophene3carboxamide
ZINC000020352865
ZINC96438244

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.