Vitas-M small molecule compound
(4E)-5-[4-(benzyloxy)phenyl]-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
STL041374
SMILES CCOc1ccc2c(c1)sc(n2)N1C(=O)C(=O)/C(=C(\c2ccc3c(c2)CC(O3)C)/O)/C1c1ccc(cc1)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 C36H30N2O6S MW 618.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H30N2O6S/c1-3-42-27-14-15-28-30(19-27)45-36(37-28)38-32(23-9-12-26(13-10-23)43-20-22-7-5-4-6-8-22)31(34(40)35(38)41)33(39)24-11-16-29-25(18-24)17-21(2)44-29/h4-16,18-19,21,32,39H,3,17,20H2,1-2H3/b33-31+InChIKey
XVIZRDQQAZZLMS-QOSDPKFLSA-NSynonyms
893698-79-8(4E)1(6ETHOXY13BENZOTHIAZOL2YL)4(HYDROXY(2METHYL23DIHYDRO1BENZOFURAN5YL)METHYLIDENE)5(4PHENYLMETHOXYPHENYL)PYRROLIDINE23DIONE
(4E)5(4(benzyloxy)phenyl)1(6ethoxy13benzothiazol2yl)4(hydroxy(2methyl23dihydro1benzofuran5yl)methylidene)pyrrolidine23dione
893698798
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
CCOc1ccc2c(c1)sc(n2)N1C(=O)C(=O)C(=C(c2ccc3c(c2)CC(O3)C)O)C1c1ccc(cc1)OCc1ccccc1
InChI=1SC36H30N2O6Sc13422714152830(1927)4536(3728)3832(2391226(131023)4320227546822)31(34(40)35(38)41)33(39)2411162925(1824)1721(2)4429h4161819213239H31720H212H3b3331+
MFCD05737506
ZINC000102870173
ZINC000102870182
Check stock
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Check stock on Vitas-MAvailable files
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