Vitas-M small molecule compound
11-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-methyl-3-(4-methylbenzyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STL225889
SMILES Cc1ccc(cc1)Cn1c(C)nc2c(c1=O)c1nc3ccccc3nc1n2c1ccc2c(c1)OCCO2
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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 C29H23N5O3 MW 489.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H23N5O3/c1-17-7-9-19(10-8-17)16-33-18(2)30-27-25(29(33)35)26-28(32-22-6-4-3-5-21(22)31-26)34(27)20-11-12-23-24(15-20)37-14-13-36-23/h3-12,15H,13-14,16H2,1-2H3InChIKey
ZEFUYOLWUSHVJT-UHFFFAOYSA-NSynonyms
836633-79-511(23dihydro14benzodioxin6yl)2methyl3(4methylbenzyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
11(23dihydrobenzo(b)(14)dioxin6yl)2methyl3(4methylbenzyl)3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
836633795
CC1=CC=C(C=C1)CN2C(=NC3=C(C2=O)C4=NC5=CC=CC=C5N=C4N3C6=CC7=C(C=C6)OCCO7)C
InChI=1SC29H23N5O3c1177919(10817)163318(2)302725(29(33)35)2628(3222643521(22)3126)34(27)2011122324(1520)3714133623h31215H131416H212H3
MFCD03689333
ZINC000009461982
ZINC09461982
ZINC9461982
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