Vitas-M small molecule compound
1-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-4-(1-benzofuran-2-ylcarbonyl)-3-hydroxy-5-[4-(prop-2-en-1-yloxy)phenyl]-1,5-dihydro-2H-pyrrol-2-one
Catalog ID
STK817697
SMILES C=CCOc1ccc(cc1)C1N(c2nc(c(s2)C(=O)C)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 C28H22N2O6S MW 514.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22N2O6S/c1-4-13-35-19-11-9-17(10-12-19)23-22(24(32)21-14-18-7-5-6-8-20(18)36-21)25(33)27(34)30(23)28-29-15(2)26(37-28)16(3)31/h4-12,14,23,33H,1,13H2,2-3H3InChIKey
LWLPAUIRAUZKMA-UHFFFAOYSA-NSynonyms
1(5ACETYL4METHYL13THIAZOL2YL)3(1BENZOFURAN2CARBONYL)4HYDROXY2(4PROP2ENOXYPHENYL)2HPYRROL5ONE
1(5acetyl4methyl13thiazol2yl)4(1benzofuran2ylcarbonyl)3hydroxy5(4(prop2en1yloxy)phenyl)15dihydro2Hpyrrol2one
1(5ACETYL4METHYL13THIAZOL2YL)5(4(ALLYLOXY)PHENYL)4(1BENZOFURAN2YLCARBONYL)3HYDROXY15DIHYDRO2HPYRROL2ONE
CC1=C(SC(=N1)N2C(C(=C(C2=O)O)C(=O)C3=CC4=CC=CC=C4O3)C5=CC=C(C=C5)OCC=C)C(=O)C
InChI=1SC28H22N2O6Sc1413351911917(101219)2322(24(32)211418756820(18)3621)25(33)27(34)30(23)282915(2)26(3728)16(3)31h412142333H113H223H3
MFCD04147941
ZINC000008441167
ZINC000008441169
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