Vitas-M small molecule compound

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

Catalog ID
STL046895
SMILES CC[NH+](CCCN1C(=O)C(=O)/C(=C(\c2c(C)nc3n2cccc3)/[O-])/C1c1cccc(c1)Br)CC

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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 C26H29BrN4O3 MW 525.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29BrN4O3/c1-4-29(5-2)13-9-15-31-23(18-10-8-11-19(27)16-18)21(25(33)26(31)34)24(32)22-17(3)28-20-12-6-7-14-30(20)22/h6-8,10-12,14,16,23,32H,4-5,9,13,15H2,1-3H3/b24-21+
InChIKey
RYXBTPZDMJWJHL-DARPEHSRSA-N
Synonyms
630063-50-2
(4E)5(3BROMOPHENYL)1(3(DIETHYLAMINO)PROPYL)4(HYDROXY(2METHYLIMIDAZO(12A)PYRIDIN3YL)METHYLIDENE)PYRROLIDINE23DIONE
(E)(2(3bromophenyl)1(3(diethylammonio)propyl)45dioxopyrrolidin3ylidene)(2methylimidazo(12a)pyridin3yl)methanolate
(E)(2(3BROMOPHENYL)1(3(DIETHYLAZANIUMYL)PROPYL)45DIOXOPYRROLIDIN3YLIDENE)(2METHYLIMIDAZO(12A)PYRIDIN3YL)METHANOLATE
1(3(DIETHYLAMINO)PROPYL)5(3BROMOPHENYL)3HYDROXY4((2METHYL(4HYDROIMIDAZO(12A)PYRIDIN3YL))CARBONYL)3PYRROLIN2ONE
630063502
CC(NH+)(CC)CCCN1C(C(=C(C2=C(N=C3N2C=CC=C3)C)(O))C(=O)C1=O)C4=CC(=CC=C4)Br
CC(NH+)(CCCN1C(=O)C(=O)C(=C(c2c(C)nc3n2cccc3)(O))C1c1cccc(c1)Br)CC
InChI=1SC26H29BrN4O3c1429(52)139153123(181081119(27)1618)21(25(33)26(31)34)24(32)2217(3)282012671430(20)22h68101214162332H4591315H213H3b2421+
MFCD18248948
ZINC000009007851
ZINC000009007852

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Available files

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