Vitas-M small molecule compound
(2E)-2-cyano-3-(3-ethoxy-4-{2-[(2-methylphenyl)amino]-2-oxoethoxy}phenyl)prop-2-enamide
Catalog ID
STL368756
SMILES CCOc1cc(ccc1OCC(=O)Nc1ccccc1C)/C=C(/C(=O)N)\C#N
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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 C21H21N3O4 MW 379.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3O4/c1-3-27-19-11-15(10-16(12-22)21(23)26)8-9-18(19)28-13-20(25)24-17-7-5-4-6-14(17)2/h4-11H,3,13H2,1-2H3,(H2,23,26)(H,24,25)/b16-10+InChIKey
MMQMCEHBOPXTEA-MHWRWJLKSA-NSynonyms
(2E)2cyano3(3ethoxy4(2((2methylphenyl)amino)2oxoethoxy)phenyl)prop2enamide
(E)2cyano3(3ethoxy4(2(2methylanilino)2oxoethoxy)phenyl)prop2enamide
CCOC1=C(C=CC(=C1)C=C(C#N)C(=O)N)OCC(=O)NC2=CC=CC=C2C
CCOc1cc(ccc1OCC(=O)Nc1ccccc1C)C=C(C(=O)N)C#N
InChI=1SC21H21N3O4c1327191115(1016(1222)21(23)26)8918(19)281320(25)2417754614(17)2h411H313H212H3(H22326)(H2425)b1610+
MFCD28950830
ZINC000098086501
ZINC98086501
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