Vitas-M small molecule compound

(E)-{2-(3-bromophenyl)-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}(2-methylimidazo[1,2-a]pyridin-3-yl)methanolate

Catalog ID
STK559795
SMILES Brc1cccc(c1)C1N(CCC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1c(C)nc2n1cccc2)/[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 C26H27BrN4O4 MW 539.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27BrN4O4/c1-17-22(30-10-3-2-8-20(30)28-17)24(32)21-23(18-6-4-7-19(27)16-18)31(26(34)25(21)33)11-5-9-29-12-14-35-15-13-29/h2-4,6-8,10,16,23,32H,5,9,11-15H2,1H3/b24-21+
InChIKey
MCVPULNYPMETKH-DARPEHSRSA-N
Synonyms
630062-52-1
(4E)5(3BROMOPHENYL)4(HYDROXY(2METHYLIMIDAZO(12A)PYRIDIN3YL)METHYLIDENE)1(3MORPHOLIN4YLPROPYL)PYRROLIDINE23DIONE
(E)(2(3bromophenyl)1(3(morpholin4ium4yl)propyl)45dioxopyrrolidin3ylidene)(2methylimidazo(12a)pyridin3yl)methanolate
(E)(2(3BROMOPHENYL)1(3MORPHOLIN4IUM4YLPROPYL)45DIOXOPYRROLIDIN3YLIDENE)(2METHYLIMIDAZO(12A)PYRIDIN3YL)METHANOLATE
5(3BROMOPHENYL)3HYDROXY4((2METHYL(4HYDROIMIDAZO(12A)PYRIDIN3YL))CARBONYL)1(3MORPHOLIN4YLPROPYL)3PYRROLIN2ONE
630062521
Brc1cccc(c1)C1N(CCC(NH+)2CCOCC2)C(=O)C(=O)C1=C(c1c(C)nc2n1cccc2)(O)
CC1=C(N2C=CC=CC2=N1)C(=C3C(N(C(=O)C3=O)CCC(NH+)4CCOCC4)C5=CC(=CC=C5)Br)(O)
InChI=1SC26H27BrN4O4c11722(301032820(30)2817)24(32)2123(1864719(27)1618)31(26(34)25(21)33)115929121435151329h246810162332H591115H21H3b2421+
MFCD18243368
ZINC000101101118
ZINC000101101120

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Available files

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