Vitas-M small molecule compound
(E)-{2-(4-bromophenyl)-1-[3-(1H-imidazol-3-ium-1-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}(2-methylimidazo[1,2-a]pyridin-3-yl)methanolate
Catalog ID
STK565893
SMILES Brc1ccc(cc1)C1N(CCCn2cc[nH+]c2)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 C25H22BrN5O3 MW 520.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22BrN5O3/c1-16-21(30-12-3-2-5-19(30)28-16)23(32)20-22(17-6-8-18(26)9-7-17)31(25(34)24(20)33)13-4-11-29-14-10-27-15-29/h2-3,5-10,12,14-15,22,32H,4,11,13H2,1H3/b23-20+InChIKey
KWYRFYOIFGEOCU-BSYVCWPDSA-NSynonyms
630068-89-2(4E)5(4BROMOPHENYL)4(HYDROXY(2METHYLIMIDAZO(12A)PYRIDIN3YL)METHYLIDENE)1(3IMIDAZOL1YLPROPYL)PYRROLIDINE23DIONE
(E)(2(4bromophenyl)1(3(1Himidazol3ium1yl)propyl)45dioxopyrrolidin3ylidene)(2methylimidazo(12a)pyridin3yl)methanolate
630068892
Brc1ccc(cc1)C1N(CCCn2cc(nH+)c2)C(=O)C(=O)C1=C(c1c(C)nc2n1cccc2)(O)
CC1=C(N2C=CC=CC2=N1)C(=C3C(N(C(=O)C3=O)CCCN4C=CN=C4)C5=CC=C(C=C5)Br)O
InChI=1SC25H22BrN5O3c11621(301232519(30)2816)23(32)2022(176818(26)9717)31(25(34)24(20)33)13411291410271529h235101214152232H41113H21H3b2320+
MFCD18244892
ZINC000101072306
ZINC000101072309
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