Vitas-M small molecule compound

ethyl 2-(propanoylamino)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate

Catalog ID
STK449020
SMILES CCOC(=O)c1c(NC(=O)CC)sc2c1CCCCCC2

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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 C16H23NO3S MW 309.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H23NO3S/c1-3-13(18)17-15-14(16(19)20-4-2)11-9-7-5-6-8-10-12(11)21-15/h3-10H2,1-2H3,(H,17,18)
InChIKey
IEIFHIAJPXQCRY-UHFFFAOYSA-N
Synonyms

CCC(=O)NC1=C(C2=C(S1)CCCCCC2)C(=O)OCC
ethyl2(propanoylamino)456789hexahydrocycloocta(b)thiophene3carboxylate
InChI=1SC16H23NO3Sc1313(18)171514(16(19)2042)11975681012(11)2115h310H212H3(H1718)
MFCD01338745
ZINC000005428023
ZINC05428023
ZINC5428023

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Available files

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