Vitas-M small molecule compound

11-{[(E)-(4-fluorophenyl)methylidene]amino}-3-(2-phenylethyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one

Catalog ID
STK558492
SMILES Fc1ccc(cc1)/C=N/n1c2nc3ccccc3nc2c2c1ncn(c2=O)CCc1ccccc1

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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 C27H19FN6O MW 462.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H19FN6O/c28-20-12-10-19(11-13-20)16-30-34-25-23(24-26(34)32-22-9-5-4-8-21(22)31-24)27(35)33(17-29-25)15-14-18-6-2-1-3-7-18/h1-13,16-17H,14-15H2/b30-16+
InChIKey
ZMXGRLDBKUSYAX-OKCVXOCRSA-N
Synonyms
860770-77-0
(E)11((4fluorobenzylidene)amino)3phenethyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
11(((E)(4fluorophenyl)methylidene)amino)3(2phenylethyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
860770770
C1=CC=C(C=C1)CCN2C=NC3=C(C2=O)C4=NC5=CC=CC=C5N=C4N3N=CC6=CC=C(C=C6)F
Fc1ccc(cc1)C=Nn1c2nc3ccccc3nc2c2c1ncn(c2=O)CCc1ccccc1
InChI=1SC27H19FN6Oc2820121019(111320)1630342523(2426(34)3222954821(22)3124)27(35)33(172925)1514186213718h1131617H1415H2b3016+
MFCD04032514
ZINC000002395935
ZINC33365039

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Available files

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