Vitas-M small molecule compound

ethyl 6-ethyl-2-[(2-methylpropanoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Catalog ID
STK453041
SMILES CCOC(=O)c1c(NC(=O)C(C)C)sc2c1CCC(C2)CC

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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 C17H25NO3S MW 323.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H25NO3S/c1-5-11-7-8-12-13(9-11)22-16(18-15(19)10(3)4)14(12)17(20)21-6-2/h10-11H,5-9H2,1-4H3,(H,18,19)
InChIKey
SEBKFTAHSBLODE-UHFFFAOYSA-N
Synonyms

CCC1CCC2=C(C1)SC(=C2C(=O)OCC)NC(=O)C(C)C
ethyl6ethyl2((2methylpropanoyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl6ethyl2(2methylpropanoylamino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC17H25NO3Sc1511781213(911)2216(1815(19)10(3)4)14(12)17(20)2162h1011H59H214H3(H1819)
MFCD02605707
ZINC000002752616
ZINC000002752617

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Available files

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