Vitas-M small molecule compound

methyl 2-({1-[(furan-2-ylcarbonyl)amino]-2-oxo-2-phenylethyl}amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate

Catalog ID
STK821518
SMILES COC(=O)c1c(NC(C(=O)c2ccccc2)NC(=O)c2ccco2)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 C22H20N2O5S MW 424.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N2O5S/c1-28-22(27)17-14-9-5-11-16(14)30-21(17)24-19(18(25)13-7-3-2-4-8-13)23-20(26)15-10-6-12-29-15/h2-4,6-8,10,12,19,24H,5,9,11H2,1H3,(H,23,26)
InChIKey
IUGTZPWDHWHPDA-UHFFFAOYSA-N
Synonyms
313960-55-3
313960553
COC(=O)C1=C(SC2=C1CCC2)NC(C(=O)C3=CC=CC=C3)NC(=O)C4=CC=CO4
InChI=1SC22H20N2O5Sc12822(27)1714951116(14)3021(17)2419(18(25)137324813)2320(26)15106122915h246810121924H5911H21H3(H2326)
methyl2((1((furan2ylcarbonyl)amino)2oxo2phenylethyl)amino)56dihydro4Hcyclopenta(b)thiophene3carboxylate
METHYL2((1(FURAN2CARBONYLAMINO)2OXO2PHENYLETHYL)AMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE
METHYL2((1(FURAN2YLFORMAMIDO)2OXO2PHENYLETHYL)AMINO)4H5H6HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE
MFCD00790376
ZINC000000631267
ZINC000000631269

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Available files

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