Vitas-M small molecule compound

methyl 2-[(1,3-benzodioxol-5-ylcarbonyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate

Catalog ID
STK420755
SMILES COC(=O)c1c(NC(=O)c2ccc3c(c2)OCO3)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 C17H15NO5S MW 345.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15NO5S/c1-21-17(20)14-10-3-2-4-13(10)24-16(14)18-15(19)9-5-6-11-12(7-9)23-8-22-11/h5-7H,2-4,8H2,1H3,(H,18,19)
InChIKey
NVLLGPKKSLSYHK-UHFFFAOYSA-N
Synonyms
445284-37-7
445284377
4HCYCLOPENTA(B)THIOPHENE3CARBOXYLICACID2((13BENZODIOXOL5YLCARBONYL)AMINO)56DIHYDROMETHYLESTER
COC(=O)C1=C(SC2=C1CCC2)NC(=O)C3=CC4=C(C=C3)OCO4
InChI=1SC17H15NO5Sc12117(20)141032413(10)2416(14)1815(19)9561112(79)2382211h57H248H21H3(H1819)
methyl2((13benzodioxol5ylcarbonyl)amino)56dihydro4Hcyclopenta(b)thiophene3carboxylate
METHYL2(13BENZODIOXOLE5CARBONYLAMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE
METHYL2(2H13BENZODIOXOLE5AMIDO)4H5H6HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE
METHYL2(BENZO(D)(13)DIOXOLE5CARBOXAMIDO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE
MFCD02371434
ZINC000000473384
ZINC00473384
ZINC473384

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Available files

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