Vitas-M small molecule compound

ethyl 4-cyano-5-({[(3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl]acetyl}amino)-3-methylthiophene-2-carboxylate

Catalog ID
STK546627
SMILES CCOC(=O)c1sc(c(c1C)C#N)NC(=O)CSc1nc(C)cc(c1C#N)C

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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 C19H18N4O3S2 MW 414.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N4O3S2/c1-5-26-19(25)16-12(4)14(8-21)18(28-16)23-15(24)9-27-17-13(7-20)10(2)6-11(3)22-17/h6H,5,9H2,1-4H3,(H,23,24)
InChIKey
JAEKHQRRETWEMY-UHFFFAOYSA-N
Synonyms
445266-11-5
445266115
4CYANO5((2((3CYANO46DIMETHYL2PYRIDINYL)THIO)1OXOETHYL)AMINO)3METHYL2THIOPHENECARBOXYLICACIDETHYLESTER
4CYANO5((2((3CYANO46DIMETHYL2PYRIDYL)THIO)ACETYL)AMINO)3METHYLTHIOPHENE2CARBOXYLICACIDETHYLESTER
4CYANO5(2(3CYANO46DIMETHYLPYRIDIN2YLSULFANYL)ACETYLAMINO)3METHYLTHIOPHENE2CARBOXYLICACIDETHYLESTER
CCOC(=O)C1=C(C(=C(S1)NC(=O)CSC2=C(C(=CC(=N2)C)C)C#N)C#N)C
ethyl4cyano5((((3cyano46dimethylpyridin2yl)sulfanyl)acetyl)amino)3methylthiophene2carboxylate
ETHYL4CYANO5((2(3CYANO46DIMETHYLPYRIDIN2YL)SULFANYLACETYL)AMINO)3METHYLTHIOPHENE2CARBOXYLATE
ethyl4cyano5(2((3cyano46dimethylpyridin2yl)thio)acetamido)3methylthiophene2carboxylate
ETHYL4CYANO5(2(3CYANO46DIMETHYLPYRIDIN2YL)SULFANYLETHANOYLAMINO)3METHYLTHIOPHENE2CARBOXYLATE
InChI=1SC19H18N4O3S2c152619(25)1612(4)14(821)18(2816)2315(24)9271713(720)10(2)611(3)2217h6H59H214H3(H2324)
MFCD03075667
ZINC000013285032
ZINC13285032

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.