Vitas-M small molecule compound
2-[(2-chloro-4-fluorobenzyl)amino]-2-oxoethyl (2E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate
Catalog ID
STL187616
SMILES COc1cc(/C=C/C(=O)OCC(=O)NCc2ccc(cc2Cl)F)cc(c1OC)OC
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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 C21H21ClFNO6 MW 437.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21ClFNO6/c1-27-17-8-13(9-18(28-2)21(17)29-3)4-7-20(26)30-12-19(25)24-11-14-5-6-15(23)10-16(14)22/h4-10H,11-12H2,1-3H3,(H,24,25)/b7-4+InChIKey
MZLFECTXMDRNNI-QPJJXVBHSA-NSynonyms
(2((2chloro4fluorophenyl)methylamino)2oxoethyl)(E)3(345trimethoxyphenyl)prop2enoate
2((2chloro4fluorobenzyl)amino)2oxoethyl(2E)3(345trimethoxyphenyl)prop2enoate
COC1=CC(=CC(=C1OC)OC)C=CC(=O)OCC(=O)NCC2=C(C=C(C=C2)F)Cl
COc1cc(C=CC(=O)OCC(=O)NCc2ccc(cc2Cl)F)cc(c1OC)OC
InChI=1SC21H21ClFNO6c12717813(918(282)21(17)293)4720(26)301219(25)2411145615(23)1016(14)22h410H1112H213H3(H2425)b74+
MFCD22388169
ZINC000072330837
ZINC72330837
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