Vitas-M small molecule compound

methyl N-[(2,4-dichlorophenyl)carbonyl]-2-[2-(3,4-dimethylphenyl)hydrazinyl]-3,3,3-trifluoroalaninate

Catalog ID
STK543769
SMILES COC(=O)C(C(F)(F)F)(NC(=O)c1ccc(cc1Cl)Cl)NNc1ccc(c(c1)C)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 C19H18Cl2F3N3O3 MW 464.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18Cl2F3N3O3/c1-10-4-6-13(8-11(10)2)26-27-18(17(29)30-3,19(22,23)24)25-16(28)14-7-5-12(20)9-15(14)21/h4-9,26-27H,1-3H3,(H,25,28)
InChIKey
HWBRCQNGJNKPQS-UHFFFAOYSA-N
Synonyms
487030-77-3
(S)methyl2(24dichlorobenzamido)2(2(34dimethylphenyl)hydrazinyl)333trifluoropropanoate
487030773
CC1=C(C=C(C=C1)NNC(C(=O)OC)(C(F)(F)F)NC(=O)C2=C(C=C(C=C2)Cl)Cl)C
InChI=1SC19H18Cl2F3N3O3c1104613(811(10)2)262718(17(29)30319(2223)24)2516(28)147512(20)915(14)21h492627H13H3(H2528)
METHYL2((24DICHLOROBENZOYL)AMINO)2(2(34DIMETHYLPHENYL)HYDRAZINO)333TRIFLUOROPROPANOATE
METHYL2((24DICHLOROBENZOYL)AMINO)2(2(34DIMETHYLPHENYL)HYDRAZINYL)333TRIFLUOROPROPANOATE
methylN((24dichlorophenyl)carbonyl)2(2(34dimethylphenyl)hydrazinyl)333trifluoroalaninate
MFCD03067285
ZINC000002050377
ZINC000002050378

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Available files

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