Vitas-M small molecule compound

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

Catalog ID
STK316444
SMILES CCCCCC(=O)Nc1sc2c(c1C(=O)OC)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 C17H25NO3S MW 323.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H25NO3S/c1-3-4-6-11-14(19)18-16-15(17(20)21-2)12-9-7-5-8-10-13(12)22-16/h3-11H2,1-2H3,(H,18,19)
InChIKey
HGZSDITXKOFDMO-UHFFFAOYSA-N
Synonyms
444937-37-5
444937375
CCCCCC(=O)NC1=C(C2=C(S1)CCCCC2)C(=O)OC
InChI=1SC17H25NO3Sc13461114(19)181615(17(20)212)1297581013(12)2216h311H212H3(H1819)
methyl2(hexanoylamino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
MFCD02606709
ZINC000004646408
ZINC04646408
ZINC4646408

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Available files

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