Vitas-M small molecule compound

ethyl 7-(diacetylamino)-2-[(phenylcarbonyl)amino]-1-benzothiophene-3-carboxylate

Catalog ID
STK995689
SMILES CCOC(=O)c1c(NC(=O)c2ccccc2)sc2c1cccc2N(C(=O)C)C(=O)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 C22H20N2O5S MW 424.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N2O5S/c1-4-29-22(28)18-16-11-8-12-17(24(13(2)25)14(3)26)19(16)30-21(18)23-20(27)15-9-6-5-7-10-15/h5-12H,4H2,1-3H3,(H,23,27)
InChIKey
IQNWMEBSBJKEFQ-UHFFFAOYSA-N
Synonyms
108940-11-0
108940110
CCOC(=O)C1=C(SC2=C1C=CC=C2N(C(=O)C)C(=O)C)NC(=O)C3=CC=CC=C3
ethyl2benzamido7(diacetylamino)1benzothiophene3carboxylate
ethyl7(diacetylamino)2((phenylcarbonyl)amino)1benzothiophene3carboxylate
InChI=1SC22H20N2O5Sc142922(28)18161181217(24(13(2)25)14(3)26)19(16)3021(18)2320(27)1596571015h512H4H213H3(H2327)
MFCD00344554
ZINC000009943207
ZINC09943207
ZINC9943207

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Available files

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