Vitas-M small molecule compound
ethyl [(2Z)-2-{[(4E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-4-methylhex-4-enoyl]imino}-2,3-dihydro-1,3-thiazol-4-yl]acetate
Catalog ID
STL520490
SMILES CCOC(=O)Cc1cs/c(=N\C(=O)CC/C(=C/Cc2c(OC)c(C)c3c(c2O)C(=O)OC3)/C)/[nH]1
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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 C24H28N2O7S MW 488.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28N2O7S/c1-5-32-19(28)10-15-12-34-24(25-15)26-18(27)9-7-13(2)6-8-16-21(29)20-17(11-33-23(20)30)14(3)22(16)31-4/h6,12,29H,5,7-11H2,1-4H3,(H,25,26,27)/b13-6+InChIKey
DQPGIZBXWJDRSX-AWNIVKPZSA-NSynonyms
1282457-48-0(E)ETHYL2(2(6(4HYDROXY6METHOXY7METHYL3OXO13DIHYDROISOBENZOFURAN5YL)4METHYLHEX4ENAMIDO)THIAZOL4YL)ACETATE
1282457480
52905085
ethyl((2Z)2(((4E)6(4hydroxy6methoxy7methyl3oxo13dihydro2benzofuran5yl)4methylhex4enoyl)imino)23dihydro13thiazol4yl)acetate
ethyl2(2(((~(E))6(4hydroxy6methoxy7methyl3oxo1~(H)2benzofuran5yl)4methylhex4enoyl)amino)13thiazol4yl)acetate
InChI=1SC24H28N2O7Sc153219(28)1015123424(2515)2618(27)9713(2)681621(29)2017(113323(20)30)14(3)22(16)314h61229H5711H214H3(H252627)b136+
MFCD31752244
ZINC000062001362
ZINC62001362
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