Vitas-M small molecule compound

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

Catalog ID
STK990734
SMILES Cc1ccc(cc1)n1c(C)nc2c(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 C27H19FN6O MW 462.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H19FN6O/c1-16-7-13-20(14-8-16)33-17(2)30-25-23(27(33)35)24-26(32-22-6-4-3-5-21(22)31-24)34(25)29-15-18-9-11-19(28)12-10-18/h3-15H,1-2H3/b29-15+
InChIKey
POUMNNVFGJIDET-WKULSOCRSA-N
Synonyms

11(((E)(4fluorophenyl)methylidene)amino)2methyl3(4methylphenyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
CC1=CC=C(C=C1)N2C(=NC3=C(C2=O)C4=NC5=CC=CC=C5N=C4N3N=CC6=CC=C(C=C6)F)C
Cc1ccc(cc1)n1c(C)nc2c(c1=O)c1nc3ccccc3nc1n2N=Cc1ccc(cc1)F
InChI=1SC27H19FN6Oc11671320(14816)3317(2)302523(27(33)35)2426(3222643521(22)3124)34(25)29151891119(28)121018h315H12H3b2915+
MFCD07801660
ZINC000008836078
ZINC102983084

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Available files

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