Vitas-M small molecule compound
3-hydroxy-4-[(2E)-3-phenylprop-2-enoyl]-1-(1,3-thiazol-2-yl)-5-(3,4,5-trimethoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
Catalog ID
STK818918
SMILES COc1cc(cc(c1OC)OC)C1N(c2nccs2)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 C25H22N2O6S MW 478.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N2O6S/c1-31-18-13-16(14-19(32-2)23(18)33-3)21-20(17(28)10-9-15-7-5-4-6-8-15)22(29)24(30)27(21)25-26-11-12-34-25/h4-14,21,29H,1-3H3/b10-9+InChIKey
AMBCHTZIKTUBAZ-MDZDMXLPSA-NSynonyms
3hydroxy4((2E)3phenylprop2enoyl)1(13thiazol2yl)5(345trimethoxyphenyl)15dihydro2Hpyrrol2one
4HYDROXY3((E)3PHENYLPROP2ENOYL)1(13THIAZOL2YL)2(345TRIMETHOXYPHENYL)2HPYRROL5ONE
COC1=CC(=CC(=C1OC)OC)C2C(=C(C(=O)N2C3=NC=CS3)O)C(=O)C=CC4=CC=CC=C4
COc1cc(cc(c1OC)OC)C1N(c2nccs2)C(=O)C(=C1C(=O)C=Cc1ccccc1)O
InChI=1SC25H22N2O6Sc131181316(1419(322)23(18)333)2120(17(28)109157546815)22(29)24(30)27(21)252611123425h4142129H13H3b109+
MFCD06310640
ZINC000016737078
ZINC000016737080
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