Vitas-M small molecule compound
3-benzyl-11-(4-methoxybenzyl)-2-methyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STL238734
SMILES COc1ccc(cc1)Cn1c2nc(C)n(c(=O)c2c2c1nc1ccccc1n2)Cc1ccccc1
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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 C28H23N5O2 MW 461.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23N5O2/c1-18-29-26-24(28(34)32(18)16-19-8-4-3-5-9-19)25-27(31-23-11-7-6-10-22(23)30-25)33(26)17-20-12-14-21(35-2)15-13-20/h3-15H,16-17H2,1-2H3InChIKey
IFUDLLDOAXJTFN-UHFFFAOYSA-NSynonyms
3benzyl11(4methoxybenzyl)2methyl311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
3benzyl11(4methoxybenzyl)2methyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
CC1=NC2=C(C3=NC4=CC=CC=C4N=C3N2CC5=CC=C(C=C5)OC)C(=O)N1CC6=CC=CC=C6
InChI=1SC28H23N5O2c118292624(28(34)32(18)16198435919)2527(312311761022(23)3025)33(26)1720121421(352)151320h315H1617H212H3
MFCD02985713
ZINC000002252159
ZINC02252159
ZINC2252159
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