Vitas-M small molecule compound

5-{[3-(ethoxycarbonyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]amino}-3-methyl-5-oxopentanoic acid

Catalog ID
STK467123
SMILES CCOC(=O)c1c(NC(=O)CC(CC(=O)O)C)sc2c1CCC2

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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 C16H21NO5S MW 339.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H21NO5S/c1-3-22-16(21)14-10-5-4-6-11(10)23-15(14)17-12(18)7-9(2)8-13(19)20/h9H,3-8H2,1-2H3,(H,17,18)(H,19,20)
InChIKey
UYTVNZKDGVRHNK-UHFFFAOYSA-N
Synonyms

4(N(3(ETHOXYCARBONYL)(456TRIHYDROCYCLOPENTA(21D)THIOPHEN2YL))CARBAMOYL)3METHYLBUTANOICACID
5((3(ethoxycarbonyl)56dihydro4Hcyclopenta(b)thiophen2yl)amino)3methyl5oxopentanoicacid
5((3ethoxycarbonyl56dihydro4Hcyclopenta(b)thiophen2yl)amino)3methyl5oxopentanoicacid
CCOC(=O)C1=C(SC2=C1CCC2)NC(=O)CC(C)CC(=O)O
InChI=1SC16H21NO5Sc132216(21)141054611(10)2315(14)1712(18)79(2)813(19)20h9H38H212H3(H1718)(H1920)
MFCD06060211
ZINC000017071106
ZINC000017071107

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Available files

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