Vitas-M small molecule compound
ethyl 2-(octanoylamino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Catalog ID
STK467203
SMILES CCCCCCCC(=O)Nc1sc2c(c1C(=O)OCC)CCCCC2
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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 C20H31NO3S MW 365.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H31NO3S/c1-3-5-6-7-11-14-17(22)21-19-18(20(23)24-4-2)15-12-9-8-10-13-16(15)25-19/h3-14H2,1-2H3,(H,21,22)InChIKey
DXKROQFMXCSUGF-UHFFFAOYSA-NSynonyms
CCCCCCCC(=O)NC1=C(C2=C(S1)CCCCC2)C(=O)OCC
ethyl2(octanoylamino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
InChI=1SC20H31NO3Sc13567111417(22)211918(20(23)2442)151298101316(15)2519h314H212H3(H2122)
MFCD03382348
ZINC000097941892
ZINC97941892
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