Vitas-M small molecule compound
1-(5-acetyl-4-methyl-1,3-thiazol-2-yl)-3-hydroxy-5-(3-methoxyphenyl)-4-[(2E)-3-phenylprop-2-enoyl]-1,5-dihydro-2H-pyrrol-2-one
Catalog ID
STK818643
SMILES COc1cccc(c1)C1N(c2nc(c(s2)C(=O)C)C)C(=O)C(=C1C(=O)/C=C/c1ccccc1)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 C26H22N2O5S MW 474.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22N2O5S/c1-15-24(16(2)29)34-26(27-15)28-22(18-10-7-11-19(14-18)33-3)21(23(31)25(28)32)20(30)13-12-17-8-5-4-6-9-17/h4-14,22,31H,1-3H3/b13-12+InChIKey
VPTFVLBHPXWARB-OUKQBFOZSA-NSynonyms
1(5acetyl4methyl13thiazol2yl)3hydroxy5(3methoxyphenyl)4((2E)3phenylprop2enoyl)15dihydro2Hpyrrol2one
1(5ACETYL4METHYL13THIAZOL2YL)4HYDROXY2(3METHOXYPHENYL)3((E)3PHENYLPROP2ENOYL)2HPYRROL5ONE
CC1=C(SC(=N1)N2C(C(=C(C2=O)O)C(=O)C=CC3=CC=CC=C3)C4=CC(=CC=C4)OC)C(=O)C
COc1cccc(c1)C1N(c2nc(c(s2)C(=O)C)C)C(=O)C(=C1C(=O)C=Cc1ccccc1)O
InChI=1SC26H22N2O5Sc11524(16(2)29)3426(2715)2822(181071119(1418)333)21(23(31)25(28)32)20(30)1312178546917h4142231H13H3b1312+
MFCD04447966
ZINC000016736922
ZINC000016736924
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