Vitas-M small molecule compound

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

Catalog ID
STL428957
SMILES CCCCCCCCCCCC(=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 C23H37NO3S MW 407.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H37NO3S/c1-3-4-5-6-7-8-9-10-14-17-20(25)24-22-21(23(26)27-2)18-15-12-11-13-16-19(18)28-22/h3-17H2,1-2H3,(H,24,25)
InChIKey
GSGSVRAOGNHSOJ-UHFFFAOYSA-N
Synonyms

CCCCCCCCCCCC(=O)NC1=C(C2=C(S1)CCCCC2)C(=O)OC
InChI=1SC23H37NO3Sc1345678910141720(25)242221(23(26)272)18151211131619(18)2822h317H212H3(H2425)
methyl2(dodecanoylamino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
MFCD01346251
ZINC000102403985
ZINC102403985

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Available files

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