Vitas-M small molecule compound
11-{[(E)-(3-chlorophenyl)methylidene]amino}-3-(2-methoxyethyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK646351
SMILES COCCn1cnc2c(c1=O)c1nc3ccccc3nc1n2/N=C/c1cccc(c1)Cl
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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 C22H17ClN6O2 MW 432.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17ClN6O2/c1-31-10-9-28-13-24-20-18(22(28)30)19-21(27-17-8-3-2-7-16(17)26-19)29(20)25-12-14-5-4-6-15(23)11-14/h2-8,11-13H,9-10H2,1H3/b25-12+InChIKey
BRZUBEFBSBDBEN-BRJLIKDPSA-NSynonyms
861109-58-2(E)11((3chlorobenzylidene)amino)3(2methoxyethyl)3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
11(((E)(3chlorophenyl)methylidene)amino)3(2methoxyethyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
861109582
COCCN1C=NC2=C(C1=O)C3=NC4=CC=CC=C4N=C3N2N=CC5=CC(=CC=C5)Cl
COCCn1cnc2c(c1=O)c1nc3ccccc3nc1n2N=Cc1cccc(c1)Cl
InChI=1SC22H17ClN6O2c1311092813242018(22(28)30)1921(2717832716(17)2619)29(20)25121454615(23)1114h281113H910H21H3b2512+
MFCD04191202
ZINC000002426655
ZINC33368880
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