Vitas-M small molecule compound
(4E)-5-[4-(benzyloxy)-3-methoxyphenyl]-1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]pyrrolidine-2,3-dione
Catalog ID
STK566829
SMILES CCOc1ccc2c(c1)sc(n2)N1C(=O)C(=O)/C(=C(\c2ccc3c(c2)CC(O3)C)/O)/C1c1ccc(c(c1)OC)OCc1ccccc1
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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 C37H32N2O7S MW 648.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H32N2O7S/c1-4-44-26-12-13-27-31(19-26)47-37(38-27)39-33(23-10-15-29(30(18-23)43-3)45-20-22-8-6-5-7-9-22)32(35(41)36(39)42)34(40)24-11-14-28-25(17-24)16-21(2)46-28/h5-15,17-19,21,33,40H,4,16,20H2,1-3H3/b34-32+InChIKey
OFSFZJIZXPIFLN-NWBJSICCSA-NSynonyms
893698-43-6(4E)1(6ETHOXY13BENZOTHIAZOL2YL)4(HYDROXY(2METHYL23DIHYDRO1BENZOFURAN5YL)METHYLIDENE)5(3METHOXY4PHENYLMETHOXYPHENYL)PYRROLIDINE23DIONE
(4E)5(4(benzyloxy)3methoxyphenyl)1(6ethoxy13benzothiazol2yl)4(hydroxy(2methyl23dihydro1benzofuran5yl)methylidene)pyrrolidine23dione
893698436
CCOC1=CC2=C(C=C1)N=C(S2)N3C(C(=C(C4=CC5=C(C=C4)OC(C5)C)O)C(=O)C3=O)C6=CC(=C(C=C6)OCC7=CC=CC=C7)OC
CCOc1ccc2c(c1)sc(n2)N1C(=O)C(=O)C(=C(c2ccc3c(c2)CC(O3)C)O)C1c1ccc(c(c1)OC)OCc1ccccc1
InChI=1SC37H32N2O7Sc14442612132731(1926)4737(3827)3933(23101529(30(1823)433)4520228657922)32(35(41)36(39)42)34(40)2411142825(1724)1621(2)4628h5151719213340H41620H213H3b3432+
MFCD05735537
ZINC000150453793
ZINC000150453809
Check stock
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Check stock on Vitas-MAvailable files
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