Vitas-M small molecule compound
(3E)-9-[2-(morpholin-4-yl)ethyl]-3-(4-nitrobenzylidene)-3H-imidazo[1,2-a]benzimidazol-2(9H)-one
Catalog ID
STK060186
SMILES O=C1N=c2n(/C/1=C/c1ccc(cc1)[N+](=O)[O-])c1c(n2CCN2CCOCC2)cccc1
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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 C22H21N5O4 MW 419.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N5O4/c28-21-20(15-16-5-7-17(8-6-16)27(29)30)26-19-4-2-1-3-18(19)25(22(26)23-21)10-9-24-11-13-31-14-12-24/h1-8,15H,9-14H2/b20-15+InChIKey
CMRUCMMQIBGYDO-HMMYKYKNSA-NSynonyms
(1E)4(2MORPHOLIN4YLETHYL)1((4NITROPHENYL)METHYLIDENE)IMIDAZO(12A)BENZIMIDAZOL2ONE
(3E)9(2(MORPHOLIN4YL)ETHYL)3(4NITROBENZYLIDENE)3HIMIDAZO(12A)BENZIMIDAZOL2(9H)ONE
(E)9(2morpholinoethyl)3(4nitrobenzylidene)39dihydro2Hbenzo(d)imidazo(12a)imidazol2one
C1COCCN1CCN2C3=CC=CC=C3N4C2=NC(=O)C4=CC5=CC=C(C=C5)(N+)(=O)(O)
InChI=1SC22H21N5O4c282120(15165717(8616)27(29)30)2619421318(19)25(22(26)2321)10924111331141224h1815H914H2b2015+
MFCD02162664
O=C1N=c2n(C1=Cc1ccc(cc1)(N+)(=O)(O))c1c(n2CCN2CCOCC2)cccc1
STK060186
ZINC000019939299
ZINC19939299
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