Vitas-M small molecule compound

propyl 4-{[(3-bromo-4-tert-butylphenyl)carbonyl]amino}benzoate

Catalog ID
STK050425
SMILES CCCOC(=O)c1ccc(cc1)NC(=O)c1ccc(c(c1)Br)C(C)(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 C21H24BrNO3 MW 418.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24BrNO3/c1-5-12-26-20(25)14-6-9-16(10-7-14)23-19(24)15-8-11-17(18(22)13-15)21(2,3)4/h6-11,13H,5,12H2,1-4H3,(H,23,24)
InChIKey
VNTKOYZKYKJRGM-UHFFFAOYSA-N
Synonyms

CCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)C(C)(C)C)Br
CCCOC(=O)c1ccc(cc1)NC(=O)c1ccc(c(c1)Br)C(C)(C)C
InChI=1SC21H24BrNO3c15122620(25)146916(10714)2319(24)1581117(18(22)1315)21(23)4h61113H512H214H3(H2324)
MFCD03373022
PROPYL4(((3BROMO4TERTBUTYLPHENYL)CARBONYL)AMINO)BENZOATE
PROPYL4((3BROMO4TERTBUTYLBENZOYL)AMINO)BENZOATE
STK050425
ZINC000002135339
ZINC02135339
ZINC2135339

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Available files

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