Vitas-M small molecule compound

ethyl 2-[(bicyclo[2.2.1]hept-2-ylcarbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Catalog ID
STK421334
SMILES CCOC(=O)c1c(NC(=O)C2CC3CC2CC3)sc2c1CCCC2

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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 C19H25NO3S MW 347.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H25NO3S/c1-2-23-19(22)16-13-5-3-4-6-15(13)24-18(16)20-17(21)14-10-11-7-8-12(14)9-11/h11-12,14H,2-10H2,1H3,(H,20,21)
InChIKey
FSIXZPXLTWNCOO-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3CC4CCC3C4
ethyl2((bicyclo(221)hept2ylcarbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2(bicyclo(221)heptane3carbonylamino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC19H25NO3Sc122319(22)1613534615(13)2418(16)2017(21)1410117812(14)911h111214H210H21H3(H2021)
MFCD00687485
ZINC000102606989
ZINC000102606993

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Available files

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