Vitas-M small molecule compound

hexyl 2-({[3-(trifluoromethyl)phenyl]carbamoyl}amino)benzoate

Catalog ID
STK528557
SMILES CCCCCCOC(=O)c1ccccc1NC(=O)Nc1cccc(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 C21H23F3N2O3 MW 408.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23F3N2O3/c1-2-3-4-7-13-29-19(27)17-11-5-6-12-18(17)26-20(28)25-16-10-8-9-15(14-16)21(22,23)24/h5-6,8-12,14H,2-4,7,13H2,1H3,(H2,25,26,28)
InChIKey
VUXLQNGNOKUQGS-UHFFFAOYSA-N
Synonyms

CCCCCCOC(=O)C1=CC=CC=C1NC(=O)NC2=CC=CC(=C2)C(F)(F)F
hexyl2(((3(trifluoromethyl)phenyl)carbamoyl)amino)benzoate
HEXYL2((3(TRIFLUOROMETHYL)PHENYL)CARBAMOYLAMINO)BENZOATE
hexyl2(3(3(trifluoromethyl)phenyl)ureido)benzoate
InChI=1SC21H23F3N2O3c12347132919(27)1711561218(17)2620(28)2516108915(1416)21(2223)24h5681214H24713H21H3(H2252628)
MFCD01960677
ZINC000002290146
ZINC02290146
ZINC2290146

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Available files

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