Vitas-M small molecule compound
(4E)-4-[hydroxy(4-methoxyphenyl)methylidene]-1-(6-methoxy-1,3-benzothiazol-2-yl)-5-(3-nitrophenyl)pyrrolidine-2,3-dione
Catalog ID
STK565915
SMILES COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccc(c1)[N+](=O)[O-])c1nc2c(s1)cc(cc2)OC)/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 C26H19N3O7S MW 517.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H19N3O7S/c1-35-17-8-6-14(7-9-17)23(30)21-22(15-4-3-5-16(12-15)29(33)34)28(25(32)24(21)31)26-27-19-11-10-18(36-2)13-20(19)37-26/h3-13,22,30H,1-2H3/b23-21+InChIKey
KCYVFXGCBFHELF-XTQSDGFTSA-NSynonyms
514187-32-7(4E)4(hydroxy(4methoxyphenyl)methylidene)1(6methoxy13benzothiazol2yl)5(3nitrophenyl)pyrrolidine23dione
3HYDROXY1(6METHOXYBENZOTHIAZOL2YL)4((4METHOXYPHENYL)CARBONYL)5(3NITROPHENYL)3PYRROLIN2ONE
514187327
COC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)C3=NC4=C(S3)C=C(C=C4)OC)C5=CC(=CC=C5)(N+)(=O)(O))O
COc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1cccc(c1)(N+)(=O)(O))c1nc2c(s1)cc(cc2)OC)O
InChI=1SC26H19N3O7Sc135178614(7917)23(30)2122(1543516(1215)29(33)34)28(25(32)24(21)31)262719111018(362)1320(19)3726h3132230H12H3b2321+
MFCD03807113
ZINC000102538174
ZINC000102538184
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