Vitas-M small molecule compound

ethyl 2-(propanoylamino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate

Catalog ID
STK449019
SMILES CCOC(=O)c1c(NC(=O)CC)sc2c1CCCCC2

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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 C15H21NO3S MW 295.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H21NO3S/c1-3-12(17)16-14-13(15(18)19-4-2)10-8-6-5-7-9-11(10)20-14/h3-9H2,1-2H3,(H,16,17)
InChIKey
VGLOUWHZERCLKZ-UHFFFAOYSA-N
Synonyms

CCC(=O)NC1=C(C2=C(S1)CCCCC2)C(=O)OCC
ethyl2(propanoylamino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
InChI=1SC15H21NO3Sc1312(17)161413(15(18)1942)108657911(10)2014h39H212H3(H1617)
MFCD01351870
ZINC000005428021
ZINC05428021
ZINC5428021

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Available files

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