Vitas-M small molecule compound
5-{[(2Z)-3-(5-bromo-2-ethoxyphenyl)-2-cyanoprop-2-enoyl]amino}-4-cyano-N,N,3-trimethylthiophene-2-carboxamide
Catalog ID
STK483273
SMILES CCOc1ccc(cc1/C=C(\C(=O)Nc1sc(c(c1C#N)C)C(=O)N(C)C)/C#N)Br
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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 C21H19BrN4O3S MW 487.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19BrN4O3S/c1-5-29-17-7-6-15(22)9-13(17)8-14(10-23)19(27)25-20-16(11-24)12(2)18(30-20)21(28)26(3)4/h6-9H,5H2,1-4H3,(H,25,27)/b14-8-InChIKey
BTUBTMAVIVSPSF-ZSOIEALJSA-NSynonyms
(2Z)N(5(NNDIMETHYLCARBAMOYL)3CYANO4METHYL(2THIENYL))3(5BROMO2ETHOXYPHENYL)2CYANOPROP2ENAMIDE
5(((2Z)3(5bromo2ethoxyphenyl)2cyanoprop2enoyl)amino)4cyanoNN3trimethylthiophene2carboxamide
5(((Z)3(5bromo2ethoxyphenyl)2cyanoprop2enoyl)amino)4cyanoNN3trimethylthiophene2carboxamide
CCOC1=C(C=C(C=C1)Br)C=C(C#N)C(=O)NC2=C(C(=C(S2)C(=O)N(C)C)C)C#N
CCOc1ccc(cc1C=C(C(=O)Nc1sc(c(c1C#N)C)C(=O)N(C)C)C#N)Br
InChI=1SC21H19BrN4O3Sc1529177615(22)913(17)814(1023)19(27)252016(1124)12(2)18(3020)21(28)26(3)4h69H5H214H3(H2527)b148
MFCD06141629
ZINC000013324078
ZINC13324078
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