Vitas-M small molecule compound
2-[(2-bromobenzyl)amino]-2-oxoethyl (2E)-3-(3,4-dimethoxyphenyl)prop-2-enoate
Catalog ID
STL187427
SMILES COc1cc(/C=C/C(=O)OCC(=O)NCc2ccccc2Br)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/c1-25-17-9-7-14(11-18(17)26-2)8-10-20(24)27-13-19(23)22-12-15-5-3-4-6-16(15)21/h3-11H,12-13H2,1-2H3,(H,22,23)/b10-8+InChIKey
CZRSPAFKGXILQN-CSKARUKUSA-NSynonyms
(2((2bromophenyl)methylamino)2oxoethyl)(E)3(34dimethoxyphenyl)prop2enoate
2((2bromobenzyl)amino)2oxoethyl(2E)3(34dimethoxyphenyl)prop2enoate
COC1=C(C=C(C=C1)C=CC(=O)OCC(=O)NCC2=CC=CC=C2Br)OC
COc1cc(C=CC(=O)OCC(=O)NCc2ccccc2Br)ccc1OC
InChI=1SC20H20BrNO5c125179714(1118(17)262)81020(24)271319(23)221215534616(15)21h311H1213H212H3(H2223)b108+
MFCD22388138
ZINC000072330819
ZINC72330819
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