Vitas-M small molecule compound
(4E)-4-[(4-chlorophenyl)(hydroxy)methylidene]-1-(6-methoxy-1,3-benzothiazol-2-yl)-5-(4-nitrophenyl)pyrrolidine-2,3-dione
Catalog ID
STK563488
SMILES COc1ccc2c(c1)sc(n2)N1C(c2ccc(cc2)[N+](=O)[O-])/C(=C(/c2ccc(cc2)Cl)\O)/C(=O)C1=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 C25H16ClN3O6S MW 521.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H16ClN3O6S/c1-35-17-10-11-18-19(12-17)36-25(27-18)28-21(13-4-8-16(9-5-13)29(33)34)20(23(31)24(28)32)22(30)14-2-6-15(26)7-3-14/h2-12,21,30H,1H3/b22-20+InChIKey
GTFPQGOJJCYBDT-LSDHQDQOSA-NSynonyms
514187-08-7(4E)4((4chlorophenyl)(hydroxy)methylidene)1(6methoxy13benzothiazol2yl)5(4nitrophenyl)pyrrolidine23dione
(4E)4((4CHLOROPHENYL)HYDROXYMETHYLIDENE)1(6METHOXY13BENZOTHIAZOL2YL)5(4NITROPHENYL)PYRROLIDINE23DIONE
4((4CHLOROPHENYL)CARBONYL)3HYDROXY1(6METHOXYBENZOTHIAZOL2YL)5(4NITROPHENYL)3PYRROLIN2ONE
514187087
COC1=CC2=C(C=C1)N=C(S2)N3C(C(=C(C4=CC=C(C=C4)Cl)O)C(=O)C3=O)C5=CC=C(C=C5)(N+)(=O)(O)
COc1ccc2c(c1)sc(n2)N1C(c2ccc(cc2)(N+)(=O)(O))C(=C(c2ccc(cc2)Cl)O)C(=O)C1=O
InChI=1SC25H16ClN3O6Sc1351710111819(1217)3625(2718)2821(134816(9513)29(33)34)20(23(31)24(28)32)22(30)142615(26)7314h2122130H1H3b2220+
MFCD03810877
ZINC000102520932
ZINC000102520943
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.