Vitas-M small molecule compound
11-{[(E)-(4-fluorophenyl)methylidene]amino}-3-(2-methoxyethyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STL241802
SMILES COCCn1cnc2c(c1=O)c1nc3ccccc3nc1n2/N=C/c1ccc(cc1)F
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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 C22H17FN6O2 MW 416.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17FN6O2/c1-31-11-10-28-13-24-20-18(22(28)30)19-21(27-17-5-3-2-4-16(17)26-19)29(20)25-12-14-6-8-15(23)9-7-14/h2-9,12-13H,10-11H2,1H3/b25-12+InChIKey
PZACDJPAKVNLJG-BRJLIKDPSA-NSynonyms
844653-49-2(E)11((4fluorobenzylidene)amino)3(2methoxyethyl)3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
11(((E)(4fluorophenyl)methylidene)amino)3(2methoxyethyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
844653492
COCCN1C=NC2=C(C1=O)C3=NC4=CC=CC=C4N=C3N2N=CC5=CC=C(C=C5)F
COCCn1cnc2c(c1=O)c1nc3ccccc3nc1n2N=Cc1ccc(cc1)F
InChI=1SC22H17FN6O2c13111102813242018(22(28)30)1921(2717532416(17)2619)29(20)2512146815(23)9714h291213H1011H21H3b2512+
MFCD04159291
ZINC000005156994
ZINC33916447
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