Vitas-M small molecule compound

dimethyl 2-{[(3,5-dimethoxyphenyl)carbonyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate

Catalog ID
STK843171
SMILES COC(=O)C1CCc2c1c(C(=O)OC)c(s2)NC(=O)c1cc(OC)cc(c1)OC

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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 C20H21NO7S MW 419.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21NO7S/c1-25-11-7-10(8-12(9-11)26-2)17(22)21-18-16(20(24)28-4)15-13(19(23)27-3)5-6-14(15)29-18/h7-9,13H,5-6H2,1-4H3,(H,21,22)
InChIKey
JLGWBTKVJPDDRE-UHFFFAOYSA-N
Synonyms
433687-59-3
433687593
COC1=CC(=CC(=C1)C(=O)NC2=C(C3=C(S2)CCC3C(=O)OC)C(=O)OC)OC
DIMETHYL(4S)2((35DIMETHOXYBENZOYL)AMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE34DICARBOXYLATE
dimethyl2(((35dimethoxyphenyl)carbonyl)amino)56dihydro4Hcyclopenta(b)thiophene34dicarboxylate
DIMETHYL2((35DIMETHOXYBENZOYL)AMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE34DICARBOXYLATE
dimethyl2(35dimethoxybenzamido)56dihydro4Hcyclopenta(b)thiophene34dicarboxylate
InChI=1SC20H21NO7Sc12511710(812(911)262)17(22)211816(20(24)284)1513(19(23)273)5614(15)2918h7913H56H214H3(H2122)
METHYL2((35DIMETHOXYPHENYL)CARBONYLAMINO)3(METHOXYCARBONYL)456TRIHYDROCYCLOPENTA(32B)THIOPHENE4CARBOXYLATE
MFCD02966996
ZINC000000921127
ZINC000000921129

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Available files

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