Vitas-M small molecule compound

methyl 2-(4-{[(3-chlorophenyl)carbamoyl](ethyl)amino}phenyl)-3,3,3-trifluoro-2-hydroxypropanoate

Catalog ID
STK366801
SMILES CCN(C(=O)Nc1cccc(c1)Cl)c1ccc(cc1)C(C(F)(F)F)(C(=O)OC)O

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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 C19H18ClF3N2O4 MW 430.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18ClF3N2O4/c1-3-25(17(27)24-14-6-4-5-13(20)11-14)15-9-7-12(8-10-15)18(28,16(26)29-2)19(21,22)23/h4-11,28H,3H2,1-2H3,(H,24,27)
InChIKey
IJMLSPNSYOZUGY-UHFFFAOYSA-N
Synonyms

CCN(C1=CC=C(C=C1)C(C(=O)OC)(C(F)(F)F)O)C(=O)NC2=CC(=CC=C2)Cl
InChI=1SC19H18ClF3N2O4c1325(17(27)241464513(20)1114)159712(81015)18(2816(26)292)19(2122)23h41128H3H212H3(H2427)
methyl2(4(((3chlorophenyl)carbamoyl)(ethyl)amino)phenyl)333trifluoro2hydroxypropanoate
METHYL2(4((3CHLOROPHENYL)CARBAMOYLETHYLAMINO)PHENYL)333TRIFLUORO2HYDROXYPROPANOATE
MFCD00345141
ZINC000004015599
ZINC000004015600

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Available files

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