Vitas-M small molecule compound

methyl 2-(butanoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Catalog ID
STL062336
SMILES CCCC(=O)Nc1sc2c(c1C(=O)OC)CCCC2

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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 C14H19NO3S MW 281.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H19NO3S/c1-3-6-11(16)15-13-12(14(17)18-2)9-7-4-5-8-10(9)19-13/h3-8H2,1-2H3,(H,15,16)
InChIKey
BYDZEMNWKCKNJT-UHFFFAOYSA-N
Synonyms

CCCC(=O)NC1=C(C2=C(S1)CCCC2)C(=O)OC
InChI=1SC14H19NO3Sc13611(16)151312(14(17)182)9745810(9)1913h38H212H3(H1516)
methyl2(butanoylamino)4567tetrahydro1benzothiophene3carboxylate
MFCD01337504
ZINC000000492030
ZINC00492030
ZINC492030

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Available files

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