Vitas-M small molecule compound
methyl 4-({[4-bromo-5-methyl-2-(propan-2-yl)phenoxy]acetyl}amino)benzoate
Catalog ID
STK065436
SMILES COC(=O)c1ccc(cc1)NC(=O)COc1cc(C)c(cc1C(C)C)Br
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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 C20H22BrNO4 MW 420.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22BrNO4/c1-12(2)16-10-17(21)13(3)9-18(16)26-11-19(23)22-15-7-5-14(6-8-15)20(24)25-4/h5-10,12H,11H2,1-4H3,(H,22,23)InChIKey
WTIHEHLHCOMDMH-UHFFFAOYSA-NSynonyms
CC1=CC(=C(C=C1Br)C(C)C)OCC(=O)NC2=CC=C(C=C2)C(=O)OC
COC(=O)c1ccc(cc1)NC(=O)COc1cc(C)c(cc1C(C)C)Br
InChI=1SC20H22BrNO4c112(2)161017(21)13(3)918(16)261119(23)22157514(6815)20(24)254h51012H11H214H3(H2223)
METHYL4(((4BROMO2ISOPROPYL5METHYLPHENOXY)ACETYL)AMINO)BENZOATE
METHYL4(((4BROMO5METHYL2(PROPAN2YL)PHENOXY)ACETYL)AMINO)BENZOATE
METHYL4((2(4BROMO5METHYL2PROPAN2YLPHENOXY)ACETYL)AMINO)BENZOATE
METHYL4(2(4BROMO5METHYL2(METHYLETHYL)PHENOXY)ACETYLAMINO)BENZOATE
MFCD03489109
STK065436
ZINC000000674721
ZINC00674721
ZINC674721
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