Vitas-M small molecule compound
2-[(2-bromo-4-methylphenyl)amino]-2-oxoethyl (2E)-3-(3,4-dimethoxyphenyl)prop-2-enoate
Catalog ID
STL187442
SMILES COc1cc(/C=C/C(=O)OCC(=O)Nc2ccc(cc2Br)C)ccc1OC
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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 C20H20BrNO5 MW 434.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20BrNO5/c1-13-4-7-16(15(21)10-13)22-19(23)12-27-20(24)9-6-14-5-8-17(25-2)18(11-14)26-3/h4-11H,12H2,1-3H3,(H,22,23)/b9-6+InChIKey
APZVYUMHNSABBG-RMKNXTFCSA-NSynonyms
(2(2bromo4methylanilino)2oxoethyl)(E)3(34dimethoxyphenyl)prop2enoate
2((2bromo4methylphenyl)amino)2oxoethyl(2E)3(34dimethoxyphenyl)prop2enoate
CC1=CC(=C(C=C1)NC(=O)COC(=O)C=CC2=CC(=C(C=C2)OC)OC)Br
COc1cc(C=CC(=O)OCC(=O)Nc2ccc(cc2Br)C)ccc1OC
InChI=1SC20H20BrNO5c1134716(15(21)1013)2219(23)122720(24)96145817(252)18(1114)263h411H12H213H3(H2223)b96+
MFCD15280900
ZINC000010869422
ZINC10869422
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