Vitas-M small molecule compound
(4E)-1-(4,6-dimethyl-1,3-benzothiazol-2-yl)-5-(4-ethoxyphenyl)-4-[hydroxy(phenyl)methylidene]pyrrolidine-2,3-dione
Catalog ID
STL044985
SMILES CCOc1ccc(cc1)C1/C(=C(/c2ccccc2)\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 C28H24N2O4S MW 484.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24N2O4S/c1-4-34-20-12-10-18(11-13-20)24-22(25(31)19-8-6-5-7-9-19)26(32)27(33)30(24)28-29-23-17(3)14-16(2)15-21(23)35-28/h5-15,24,31H,4H2,1-3H3/b25-22+InChIKey
VHQLJXGOUGTVAK-YYDJUVGSSA-NSynonyms
514193-53-4(4E)1(46dimethyl13benzothiazol2yl)5(4ethoxyphenyl)4(hydroxy(phenyl)methylidene)pyrrolidine23dione
1(46DIMETHYLBENZOTHIAZOL2YL)5(4ETHOXYPHENYL)3HYDROXY4(PHENYLCARBONYL)3PYRROLIN2ONE
514193534
CCOC1=CC=C(C=C1)C2C(=C(C3=CC=CC=C3)O)C(=O)C(=O)N2C4=NC5=C(C=C(C=C5S4)C)C
CCOc1ccc(cc1)C1C(=C(c2ccccc2)O)C(=O)C(=O)N1c1nc2c(s1)cc(cc2C)C
InChI=1SC28H24N2O4Sc143420121018(111320)2422(25(31)198657919)26(32)27(33)30(24)28292317(3)1416(2)1521(23)3528h5152431H4H213H3b2522+
MFCD03811058
ZINC000102876853
ZINC000102876857
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