Vitas-M small molecule compound
3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxo-6-propyl-4H-chromen-7-yl thiophene-2-carboxylate
Catalog ID
STK888714
SMILES CCCc1cc2c(cc1OC(=O)c1cccs1)occ(c2=O)c1ccc2c(c1)OCCO2
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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 C25H20O6S MW 448.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20O6S/c1-2-4-16-11-17-21(13-20(16)31-25(27)23-5-3-10-32-23)30-14-18(24(17)26)15-6-7-19-22(12-15)29-9-8-28-19/h3,5-7,10-14H,2,4,8-9H2,1H3InChIKey
JNNCYHDETQMUPI-UHFFFAOYSA-NSynonyms
610752-90-4(3(23DIHYDRO14BENZODIOXIN6YL)4OXO6PROPYLCHROMEN7YL)THIOPHENE2CARBOXYLATE
3(23DIHYDRO14BENZODIOXIN6YL)4OXO6PROPYL4HCHROMEN7YL2THIOPHENECARBOXYLATE
3(23dihydro14benzodioxin6yl)4oxo6propyl4Hchromen7ylthiophene2carboxylate
3(23DIHYDROBENZO(B)(14)DIOXIN6YL)4OXO6PROPYL4HCHROMEN7YLTHIOPHENE2CARBOXYLATE
3(2H3HBENZO(34E)14DIOXAN6YL)4OXO6PROPYLCHROMEN7YLTHIOPHENE2CARBOXYLATE
610752904
CCCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CC4=C(C=C3)OCCO4)OC(=O)C5=CC=CS5
InChI=1SC25H20O6Sc12416111721(1320(16)3125(27)2353103223)301418(24(17)26)15671922(1215)29982819h3571014H2489H21H3
MFCD03696034
ZINC000000728052
ZINC00728052
ZINC728052
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