Vitas-M small molecule compound
ethyl 2-{[(3-methyl-1-oxo-3,4-dihydro-1H-isochromen-3-yl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK865387
SMILES CCOC(=O)c1c(sc2c1CCCC2)NC(=O)C1(C)OC(=O)c2c(C1)cccc2
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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 C22H23NO5S MW 413.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23NO5S/c1-3-27-20(25)17-15-10-6-7-11-16(15)29-18(17)23-21(26)22(2)12-13-8-4-5-9-14(13)19(24)28-22/h4-5,8-9H,3,6-7,10-12H2,1-2H3,(H,23,26)InChIKey
DBZCFPZXKFKUCZ-UHFFFAOYSA-NSynonyms
708283-17-4708283174
CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3(CC4=CC=CC=C4C(=O)O3)C
ethyl2(((3methyl1oxo34dihydro1Hisochromen3yl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2((3methyl1oxo4Hisochromene3carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2(3methyl1oxoisochroman3carboxamido)4567tetrahydrobenzo(b)thiophene3carboxylate
InChI=1SC22H23NO5Sc132720(25)171510671116(15)2918(17)2321(26)22(2)1213845914(13)19(24)2822h4589H3671012H212H3(H2326)
MFCD04186662
ZINC000002421147
ZINC000002421148
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