Vitas-M small molecule compound
3-(4-chlorobenzyl)-11-[2-(4-methoxyphenyl)ethyl]-2-methyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STL225865
SMILES COc1ccc(cc1)CCn1c2nc(C)n(c(=O)c2c2c1nc1ccccc1n2)Cc1ccc(cc1)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 C29H24ClN5O2 MW 509.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H24ClN5O2/c1-18-31-27-25(29(36)35(18)17-20-7-11-21(30)12-8-20)26-28(33-24-6-4-3-5-23(24)32-26)34(27)16-15-19-9-13-22(37-2)14-10-19/h3-14H,15-17H2,1-2H3InChIKey
BXRXIEABCGTNDA-UHFFFAOYSA-NSynonyms
799830-07-23(4chlorobenzyl)11(2(4methoxyphenyl)ethyl)2methyl311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
3(4chlorobenzyl)11(4methoxyphenethyl)2methyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
799830072
CC1=NC2=C(C3=NC4=CC=CC=C4N=C3N2CCC5=CC=C(C=C5)OC)C(=O)N1CC6=CC=C(C=C6)Cl
InChI=1SC29H24ClN5O2c118312725(29(36)35(18)172071121(30)12820)2628(3324643523(24)3226)34(27)16151991322(372)141019h314H1517H212H3
MFCD03684030
ZINC000002245506
ZINC02245506
ZINC2245506
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