Vitas-M small molecule compound

ethyl 2-{[(3,5-dimethyl-1-benzofuran-2-yl)carbonyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate

Catalog ID
STK819200
SMILES CCOC(=O)c1c(NC(=O)c2oc3c(c2C)cc(cc3)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 C21H21NO4S MW 383.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21NO4S/c1-4-25-21(24)17-13-6-5-7-16(13)27-20(17)22-19(23)18-12(3)14-10-11(2)8-9-15(14)26-18/h8-10H,4-7H2,1-3H3,(H,22,23)
InChIKey
ATTIZYIMMOMIMN-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC2=C1CCC2)NC(=O)C3=C(C4=C(O3)C=CC(=C4)C)C
ethyl2(((35dimethyl1benzofuran2yl)carbonyl)amino)56dihydro4Hcyclopenta(b)thiophene3carboxylate
ETHYL2((35DIMETHYL1BENZOFURAN2CARBONYL)AMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE
InChI=1SC21H21NO4Sc142521(24)171365716(13)2720(17)2219(23)1812(3)141011(2)8915(14)2618h810H47H213H3(H2223)
MFCD04448287
ZINC000002843061
ZINC02843061
ZINC2843061

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Available files

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