Vitas-M small molecule compound
(4E)-4-[hydroxy(3-methoxyphenyl)methylidene]-1-(6-methyl-1,3-benzothiazol-2-yl)-5-(4-nitrophenyl)pyrrolidine-2,3-dione
Catalog ID
STK608567
SMILES COc1cccc(c1)/C(=C\1/C(c2ccc(cc2)[N+](=O)[O-])N(C(=O)C1=O)c1sc2c(n1)ccc(c2)C)/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 C26H19N3O6S MW 501.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H19N3O6S/c1-14-6-11-19-20(12-14)36-26(27-19)28-22(15-7-9-17(10-8-15)29(33)34)21(24(31)25(28)32)23(30)16-4-3-5-18(13-16)35-2/h3-13,22,30H,1-2H3/b23-21+InChIKey
QXWZMJUCTOQPQB-XTQSDGFTSA-NSynonyms
607686-25-9(4E)4(hydroxy(3methoxyphenyl)methylidene)1(6methyl13benzothiazol2yl)5(4nitrophenyl)pyrrolidine23dione
3HYDROXY4((3METHOXYPHENYL)CARBONYL)1(6METHYLBENZOTHIAZOL2YL)5(4NITROPHENYL)3PYRROLIN2ONE
607686259
CC1=CC2=C(C=C1)N=C(S2)N3C(C(=C(C4=CC(=CC=C4)OC)O)C(=O)C3=O)C5=CC=C(C=C5)(N+)(=O)(O)
COc1cccc(c1)C(=C1C(c2ccc(cc2)(N+)(=O)(O))N(C(=O)C1=O)c1sc2c(n1)ccc(c2)C)O
InChI=1SC26H19N3O6Sc1146111920(1214)3626(2719)2822(157917(10815)29(33)34)21(24(31)25(28)32)23(30)1643518(1316)352h3132230H12H3b2321+
MFCD08734546
ZINC000102704957
ZINC000102704961
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Check stock on Vitas-MAvailable files
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