Vitas-M small molecule compound

methyl 3-[(1-amino-2,2,2-trichloroethyl)amino]-3-oxo-2-(triphenyl-lambda~5~-phosphanylidene)propanoate

Catalog ID
STK820782
SMILES COC(=O)C(=P(c1ccccc1)(c1ccccc1)c1ccccc1)C(=O)NC(C(Cl)(Cl)Cl)N

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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 C24H22Cl3N2O3P MW 523.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22Cl3N2O3P/c1-32-22(31)20(21(30)29-23(28)24(25,26)27)33(17-11-5-2-6-12-17,18-13-7-3-8-14-18)19-15-9-4-10-16-19/h2-16,23H,28H2,1H3,(H,29,30)
InChIKey
WTJULYWMDYKFIV-UHFFFAOYSA-N
Synonyms
391224-62-7
391224627
COC(=O)C(=P(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)NC(C(Cl)(Cl)Cl)N
InChI=1SC24H22Cl3N2O3Pc13222(31)20(21(30)2923(28)24(2526)27)33(1711526121718137381418)191594101619h21623H28H21H3(H2930)
METHYL3((1AMINO222TRICHLOROETHYL)AMINO)3OXO2(TRIPHENYL
methyl3((1amino222trichloroethyl)amino)3oxo2(triphenyl$l^(5)phosphanylidene)propanoate
methyl3((1amino222trichloroethyl)amino)3oxo2(triphenyllambda~5~phosphanylidene)propanoate
METHYL3((1AMINO222TRICHLOROETHYL)AMINO)3OXO2(TRIPHENYLLAMBDA5PHOSPHANYLIDENE)PROPANOATE
METHYL3((1AMINO222TRICHLOROETHYL)AMINO)3OXO2(TRIPHENYLPHOSPHORANYLIDENE)PROPANOATE
MFCD00195263
ZINC000097961196
ZINC000097961197

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Available files

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