Vitas-M small molecule compound

methyl 4-ethyl-5-methyl-2-[(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbonyl)amino]thiophene-3-carboxylate

Catalog ID
STK443379
SMILES COC(=O)c1c(NC(=O)C23CC4CC(C3)CC(C2)C4)sc(c1CC)C

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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 C20H27NO3S MW 361.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27NO3S/c1-4-15-11(2)25-17(16(15)18(22)24-3)21-19(23)20-8-12-5-13(9-20)7-14(6-12)10-20/h12-14H,4-10H2,1-3H3,(H,21,23)
InChIKey
NRZDWDWUMMFBOW-UHFFFAOYSA-N
Synonyms
329221-34-3
329221343
CCC1=C(SC(=C1C(=O)OC)NC(=O)C23CC4CC(C2)CC(C4)C3)C
InChI=1SC20H27NO3Sc141511(2)2517(16(15)18(22)243)2119(23)20812513(920)714(612)1020h1214H410H213H3(H2123)
METHYL2(ADAMANTANE1CARBONYLAMINO)4ETHYL5METHYLTHIOPHENE3CARBOXYLATE
METHYL2(ADAMANTANYLCARBONYLAMINO)4ETHYL5METHYLTHIOPHENE3CARBOXYLATE
methyl4ethyl5methyl2((tricyclo(3311~37~)dec1ylcarbonyl)amino)thiophene3carboxylate
ZINC000005006668
ZINC05006668
ZINC5006668

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Available files

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