Vitas-M small molecule compound

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

Catalog ID
STK820670
SMILES COC(=O)c1c(NC(=O)c2noc(c2)c2ccc3c(c2)CC(O3)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 C22H20N2O5S MW 424.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N2O5S/c1-11-8-13-9-12(6-7-16(13)28-11)17-10-15(24-29-17)20(25)23-21-19(22(26)27-2)14-4-3-5-18(14)30-21/h6-7,9-11H,3-5,8H2,1-2H3,(H,23,25)
InChIKey
KBSQRMUMSHCBRE-UHFFFAOYSA-N
Synonyms

CC1CC2=C(O1)C=CC(=C2)C3=CC(=NO3)C(=O)NC4=C(C5=C(S4)CCC5)C(=O)OC
InChI=1SC22H20N2O5Sc111813912(6716(13)2811)171015(242917)20(25)232119(22(26)272)1443518(14)3021h67911H358H212H3(H2325)
methyl2(((5(2methyl23dihydro1benzofuran5yl)12oxazol3yl)carbonyl)amino)56dihydro4Hcyclopenta(b)thiophene3carboxylate
methyl2((5(2methyl23dihydro1benzofuran5yl)12oxazole3carbonyl)amino)56dihydro4Hcyclopenta(b)thiophene3carboxylate
MFCD12918362
ZINC000027792877
ZINC000027792880

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Available files

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