Vitas-M small molecule compound
(4E)-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-(4-ethoxyphenyl)-4-[hydroxy(4-methylphenyl)methylidene]pyrrolidine-2,3-dione
Catalog ID
STL149879
SMILES CCOc1ccc(cc1)C1/C(=C(/c2ccc(cc2)C)\O)/C(=O)C(=O)N1c1nc2c(s1)cc(cc2C)C
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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 C29H26N2O4S MW 498.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H26N2O4S/c1-5-35-21-12-10-19(11-13-21)25-23(26(32)20-8-6-16(2)7-9-20)27(33)28(34)31(25)29-30-24-18(4)14-17(3)15-22(24)36-29/h6-15,25,32H,5H2,1-4H3/b26-23+InChIKey
VZPPQYFQXZVONH-WNAAXNPUSA-NSynonyms
514193-68-1(4E)1(46dimethyl13benzothiazol2yl)5(4ethoxyphenyl)4(hydroxy(4methylphenyl)methylidene)pyrrolidine23dione
1(46DIMETHYLBENZOTHIAZOL2YL)5(4ETHOXYPHENYL)3HYDROXY4((4METHYLPHENYL)CARBONYL)3PYRROLIN2ONE
514193681
CCOC1=CC=C(C=C1)C2C(=C(C3=CC=C(C=C3)C)O)C(=O)C(=O)N2C4=NC5=C(C=C(C=C5S4)C)C
CCOc1ccc(cc1)C1C(=C(c2ccc(cc2)C)O)C(=O)C(=O)N1c1nc2c(s1)cc(cc2C)C
InChI=1SC29H26N2O4Sc153521121019(111321)2523(26(32)208616(2)7920)27(33)28(34)31(25)29302418(4)1417(3)1522(24)3629h6152532H5H214H3b2623+
MFCD03812708
ZINC000102929218
ZINC000102929219
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