Vitas-M small molecule compound
2-[(2-chloro-4-fluorophenyl)amino]-2-oxoethyl 3,4,5-triethoxybenzoate
Catalog ID
STL013637
SMILES CCOc1cc(cc(c1OCC)OCC)C(=O)OCC(=O)Nc1ccc(cc1Cl)F
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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 C21H23ClFNO6 MW 439.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23ClFNO6/c1-4-27-17-9-13(10-18(28-5-2)20(17)29-6-3)21(26)30-12-19(25)24-16-8-7-14(23)11-15(16)22/h7-11H,4-6,12H2,1-3H3,(H,24,25)InChIKey
IRIQWNBGCZYUKL-UHFFFAOYSA-NSynonyms
389589-93-9(2(2CHLORO4FLUOROANILINO)2OXOETHYL)345TRIETHOXYBENZOATE
2((2chloro4fluorophenyl)amino)2oxoethyl345triethoxybenzoate
389589939
CCOC1=CC(=CC(=C1OCC)OCC)C(=O)OCC(=O)NC2=C(C=C(C=C2)F)Cl
InChI=1SC21H23ClFNO6c142717913(1018(2852)20(17)2963)21(26)301219(25)24168714(23)1115(16)22h711H4612H213H3(H2425)
MFCD04610671
ZINC000003338959
ZINC03338959
ZINC3338959
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