Vitas-M small molecule compound

ethyl 2-({[(4,6-dimethylpyrimidin-2-yl)sulfanyl]acetyl}amino)-5-phenylthiophene-3-carboxylate

Catalog ID
STK215903
SMILES CCOC(=O)c1cc(sc1NC(=O)CSc1nc(C)cc(n1)C)c1ccccc1

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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 C21H21N3O3S2 MW 427.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3O3S2/c1-4-27-20(26)16-11-17(15-8-6-5-7-9-15)29-19(16)24-18(25)12-28-21-22-13(2)10-14(3)23-21/h5-11H,4,12H2,1-3H3,(H,24,25)
InChIKey
WUNFHKJUCMCJIQ-UHFFFAOYSA-N
Synonyms
710984-87-5
710984875
CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)CSC3=NC(=CC(=N3)C)C
ETHYL2((((46DIMETHYLPYRIMIDIN2YL)SULFANYL)ACETYL)AMINO)5PHENYLTHIOPHENE3CARBOXYLATE
ETHYL2((2(46DIMETHYLPYRIMIDIN2YL)SULFANYLACETYL)AMINO)5PHENYLTHIOPHENE3CARBOXYLATE
InChI=1SC21H21N3O3S2c142720(26)161117(158657915)2919(16)2418(25)1228212213(2)1014(3)2321h511H412H213H3(H2425)
MFCD05996604
ZINC000001117161
ZINC01117161
ZINC1117161

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Available files

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