Vitas-M small molecule compound
methyl 2-[3-(1-benzofuran-2-ylcarbonyl)-4-hydroxy-2-(4-methoxyphenyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STK516162
SMILES COc1ccc(cc1)C1N(c2nc(c(s2)C(=O)OC)C)C(=O)C(=C1C(=O)c1cc2c(o1)cccc2)O
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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 C26H20N2O7S MW 504.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20N2O7S/c1-13-23(25(32)34-3)36-26(27-13)28-20(14-8-10-16(33-2)11-9-14)19(22(30)24(28)31)21(29)18-12-15-6-4-5-7-17(15)35-18/h4-12,20,30H,1-3H3InChIKey
OWQSDZZWHNFPID-UHFFFAOYSA-NSynonyms
CC1=C(SC(=N1)N2C(C(=C(C2=O)O)C(=O)C3=CC4=CC=CC=C4O3)C5=CC=C(C=C5)OC)C(=O)OC
InChI=1SC26H20N2O7Sc11323(25(32)343)3626(2713)2820(1481016(332)11914)19(22(30)24(28)31)21(29)181215645717(15)3518h4122030H13H3
METHYL2(3(1BENZOFURAN2CARBONYL)4HYDROXY2(4METHOXYPHENYL)5OXO2HPYRROL1YL)4METHYL13THIAZOLE5CARBOXYLATE
methyl2(3(1benzofuran2ylcarbonyl)4hydroxy2(4methoxyphenyl)5oxo25dihydro1Hpyrrol1yl)4methyl13thiazole5carboxylate
MFCD06279824
ZINC000009557321
ZINC000009557322
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