Vitas-M small molecule compound
(2E)-3-(2-bromo-5-methoxy-4-{2-[(4-methylphenyl)amino]-2-oxoethoxy}phenyl)prop-2-enoic acid
Catalog ID
STK400590
SMILES COc1cc(/C=C/C(=O)O)c(cc1OCC(=O)Nc1ccc(cc1)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 C19H18BrNO5 MW 420.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18BrNO5/c1-12-3-6-14(7-4-12)21-18(22)11-26-17-10-15(20)13(5-8-19(23)24)9-16(17)25-2/h3-10H,11H2,1-2H3,(H,21,22)(H,23,24)/b8-5+InChIKey
LTPCTFROCABCIG-VMPITWQZSA-NSynonyms
1120284-85-6(2E)3(2bromo5methoxy4(2((4methylphenyl)amino)2oxoethoxy)phenyl)prop2enoicacid
(E)3(2bromo5methoxy4(2(4methylanilino)2oxoethoxy)phenyl)prop2enoicacid
1120284856
CC1=CC=C(C=C1)NC(=O)COC2=C(C=C(C(=C2)Br)C=CC(=O)O)OC
COc1cc(C=CC(=O)O)c(cc1OCC(=O)Nc1ccc(cc1)C)Br
InChI=1SC19H18BrNO5c1123614(7412)2118(22)1126171015(20)13(5819(23)24)916(17)252h310H11H212H3(H2122)(H2324)b85+
MFCD02256937
ZINC000022638106
ZINC22638106
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