Vitas-M small molecule compound

ethyl 6-methyl-2-{[3-(5-phenylfuran-2-yl)propanoyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Catalog ID
STK951160
SMILES CCOC(=O)c1c(NC(=O)CCc2ccc(o2)c2ccccc2)sc2c1CCC(C2)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 C25H27NO4S MW 437.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27NO4S/c1-3-29-25(28)23-19-12-9-16(2)15-21(19)31-24(23)26-22(27)14-11-18-10-13-20(30-18)17-7-5-4-6-8-17/h4-8,10,13,16H,3,9,11-12,14-15H2,1-2H3,(H,26,27)
InChIKey
YYCNLXWTKWNYIV-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC2=C1CCC(C2)C)NC(=O)CCC3=CC=C(O3)C4=CC=CC=C4
ethyl6methyl2((3(5phenylfuran2yl)propanoyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl6methyl2(3(5phenylfuran2yl)propanoylamino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC25H27NO4Sc132925(28)231912916(2)1521(19)3124(23)2622(27)141118101320(3018)177546817h48101316H3911121415H212H3(H2627)
MFCD09760236
ZINC000011689919
ZINC000011689920

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Available files

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