Vitas-M small molecule compound

ethyl 4-({[(2E)-2-({2,5-dimethyl-1-[2-(trifluoromethyl)phenyl]-1H-pyrrol-3-yl}methylidene)hydrazinyl](oxo)acetyl}amino)benzoate

Catalog ID
STK381618
SMILES CCOC(=O)c1ccc(cc1)NC(=O)C(=O)N/N=C/c1cc(n(c1C)c1ccccc1C(F)(F)F)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 C25H23F3N4O4 MW 500.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23F3N4O4/c1-4-36-24(35)17-9-11-19(12-10-17)30-22(33)23(34)31-29-14-18-13-15(2)32(16(18)3)21-8-6-5-7-20(21)25(26,27)28/h5-14H,4H2,1-3H3,(H,30,33)(H,31,34)/b29-14+
InChIKey
VKZCKAKADRZYDE-IPPBACCNSA-N
Synonyms

CCOC(=O)C1=CC=C(C=C1)NC(=O)C(=O)NN=CC2=C(N(C(=C2)C)C3=CC=CC=C3C(F)(F)F)C
CCOC(=O)c1ccc(cc1)NC(=O)C(=O)NN=Cc1cc(n(c1C)c1ccccc1C(F)(F)F)C
ethyl4((((2E)2((25dimethyl1(2(trifluoromethyl)phenyl)1Hpyrrol3yl)methylidene)hydrazinyl)(oxo)acetyl)amino)benzoate
ethyl4((2((2E)2((25dimethyl1(2(trifluoromethyl)phenyl)pyrrol3yl)methylidene)hydrazinyl)2oxoacetyl)amino)benzoate
ETHYL4((N((1E)2(25DIMETHYL1(2(TRIFLUOROMETHYL)PHENYL)PYRROL3YL)1AZAVINYL)CARBAMOYL)CARBONYLAMINO)BENZOATE
InChI=1SC25H23F3N4O4c143624(35)1791119(121017)3022(33)23(34)312914181315(2)32(16(18)3)21865720(21)25(2627)28h514H4H213H3(H3033)(H3134)b2914+
MFCD02132541
ZINC000004091335
ZINC33923028

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Available files

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