Vitas-M small molecule compound

(2E,2'E)-4,4'-(benzene-1,4-diylbis{[(1E)-3-oxoprop-1-ene-1,3-diyl]benzene-4,1-diylimino})bis(4-oxobut-2-enoic acid)

Catalog ID
STK295923
SMILES O=C(c1ccc(cc1)NC(=O)/C=C/C(=O)O)/C=C/c1ccc(cc1)/C=C/C(=O)c1ccc(cc1)NC(=O)/C=C/C(=O)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 C32H24N2O8 MW 564.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H24N2O8/c35-27(23-7-11-25(12-8-23)33-29(37)17-19-31(39)40)15-5-21-1-2-22(4-3-21)6-16-28(36)24-9-13-26(14-10-24)34-30(38)18-20-32(41)42/h1-20H,(H,33,37)(H,34,38)(H,39,40)(H,41,42)/b15-5+,16-6+,19-17+,20-18+
InChIKey
PIZBBENYSVYOIQ-FJNIKXKGSA-N
Synonyms

(2E2E)44(benzene14diylbis(((1E)3oxoprop1ene13diyl)benzene41diylimino))bis(4oxobut2enoicacid)
(E)4(4((E)3(4((E)3(4(((E)3carboxyprop2enoyl)amino)phenyl)3oxoprop1enyl)phenyl)prop2enoyl)anilino)4oxobut2enoicacid
C1=CC(=CC=C1C=CC(=O)C2=CC=C(C=C2)NC(=O)C=CC(=O)O)C=CC(=O)C3=CC=C(C=C3)NC(=O)C=CC(=O)O
InChI=1SC32H24N2O8c3527(2371125(12823)3329(37)171931(39)40)155211222(4321)61628(36)2491326(141024)3430(38)182032(41)42h120H(H3337)(H3438)(H3940)(H4142)b155+166+1917+2018+
MFCD00627959
O=C(c1ccc(cc1)NC(=O)C=CC(=O)O)C=Cc1ccc(cc1)C=CC(=O)c1ccc(cc1)NC(=O)C=CC(=O)O
ZINC000097961965
ZINC97961965

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Available files

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