Vitas-M small molecule compound
(E)-(4-bromophenyl){2-(2-fluorophenyl)-1-[2-(morpholin-4-ium-4-yl)ethyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Catalog ID
STK560146
SMILES Brc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccccc1F)CC[NH+]1CCOCC1)/[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 C23H22BrFN2O4 MW 489.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22BrFN2O4/c24-16-7-5-15(6-8-16)21(28)19-20(17-3-1-2-4-18(17)25)27(23(30)22(19)29)10-9-26-11-13-31-14-12-26/h1-8,20,28H,9-14H2/b21-19+InChIKey
NXLICWJQOHXNJO-XUTLUUPISA-NSynonyms
488109-24-6(4E)4((4BROMOPHENYL)HYDROXYMETHYLIDENE)5(2FLUOROPHENYL)1(2MORPHOLIN4YLETHYL)PYRROLIDINE23DIONE
(E)(4bromophenyl)(2(2fluorophenyl)1(2(morpholin4ium4yl)ethyl)45dioxopyrrolidin3ylidene)methanolate
(E)(4BROMOPHENYL)(2(2FLUOROPHENYL)1(2MORPHOLIN4IUM4YLETHYL)45DIOXOPYRROLIDIN3YLIDENE)METHANOLATE
488109246
Brc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1ccccc1F)CC(NH+)1CCOCC1)(O)
C1COCCN1CCN2C(C(=C(C3=CC=C(C=C3)Br)O)C(=O)C2=O)C4=CC=CC=C4F
InChI=1SC23H22BrFN2O4c24167515(6816)21(28)1920(17312418(17)25)27(23(30)22(19)29)10926111331141226h182028H914H2b2119+
MFCD18243455
ZINC000101062526
ZINC000101062527
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