Vitas-M small molecule compound
2-[(3-cyanophenyl)amino]-2-oxoethyl (2E)-3-(3,4-dimethoxyphenyl)prop-2-enoate
Catalog ID
STL187434
SMILES COc1cc(/C=C/C(=O)OCC(=O)Nc2cccc(c2)C#N)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 C20H18N2O5 MW 366.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N2O5/c1-25-17-8-6-14(11-18(17)26-2)7-9-20(24)27-13-19(23)22-16-5-3-4-15(10-16)12-21/h3-11H,13H2,1-2H3,(H,22,23)/b9-7+InChIKey
JNMHNVIVKZIHQF-VQHVLOKHSA-NSynonyms
(2(3CYANOANILINO)2OXOETHYL)(E)3(34DIMETHOXYPHENYL)PROP2ENOATE
2((3cyanophenyl)amino)2oxoethyl(2E)3(34dimethoxyphenyl)prop2enoate
COC1=C(C=C(C=C1)C=CC(=O)OCC(=O)NC2=CC=CC(=C2)C#N)OC
COc1cc(C=CC(=O)OCC(=O)Nc2cccc(c2)C#N)ccc1OC
InChI=1SC20H18N2O5c125178614(1118(17)262)7920(24)271319(23)221653415(1016)1221h311H13H212H3(H2223)b97+
MFCD15280890
ZINC000005404641
ZINC05404641
ZINC5404641
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