Vitas-M small molecule compound
(4E)-4-[(4-ethoxyphenyl)(hydroxy)methylidene]-1-(6-ethyl-1,3-benzothiazol-2-yl)-5-(4-nitrophenyl)pyrrolidine-2,3-dione
Catalog ID
STK610500
SMILES CCOc1ccc(cc1)/C(=C\1/C(c2ccc(cc2)[N+](=O)[O-])N(C(=O)C1=O)c1sc2c(n1)ccc(c2)CC)/O
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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 C28H23N3O6S MW 529.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23N3O6S/c1-3-16-5-14-21-22(15-16)38-28(29-21)30-24(17-6-10-19(11-7-17)31(35)36)23(26(33)27(30)34)25(32)18-8-12-20(13-9-18)37-4-2/h5-15,24,32H,3-4H2,1-2H3/b25-23+InChIKey
AQEGPGJVAWDOAI-WJTDDFOZSA-NSynonyms
618423-58-8(4E)4((4ethoxyphenyl)(hydroxy)methylidene)1(6ethyl13benzothiazol2yl)5(4nitrophenyl)pyrrolidine23dione
(4E)4((4ETHOXYPHENYL)HYDROXYMETHYLIDENE)1(6ETHYL13BENZOTHIAZOL2YL)5(4NITROPHENYL)PYRROLIDINE23DIONE
4((4ETHOXYPHENYL)CARBONYL)1(6ETHYLBENZOTHIAZOL2YL)3HYDROXY5(4NITROPHENYL)3PYRROLIN2ONE
618423588
CCC1=CC2=C(C=C1)N=C(S2)N3C(C(=C(C4=CC=C(C=C4)OCC)O)C(=O)C3=O)C5=CC=C(C=C5)(N+)(=O)(O)
CCOc1ccc(cc1)C(=C1C(c2ccc(cc2)(N+)(=O)(O))N(C(=O)C1=O)c1sc2c(n1)ccc(c2)CC)O
InChI=1SC28H23N3O6Sc13165142122(1516)3828(2921)3024(1761019(11717)31(35)36)23(26(33)27(30)34)25(32)1881220(13918)3742h5152432H34H212H3b2523+
MFCD08735704
ZINC000102707172
ZINC000102707176
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.