Vitas-M small molecule compound
11-(1,3-benzodioxol-5-yl)-2-methyl-3-(tetrahydrofuran-2-ylmethyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK990414
SMILES Cc1nc2n(c3ccc4c(c3)OCO4)c3c(c2c(=O)n1CC1CCCO1)nc1c(n3)cccc1
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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 C25H21N5O4 MW 455.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21N5O4/c1-14-26-23-21(25(31)29(14)12-16-5-4-10-32-16)22-24(28-18-7-3-2-6-17(18)27-22)30(23)15-8-9-19-20(11-15)34-13-33-19/h2-3,6-9,11,16H,4-5,10,12-13H2,1H3InChIKey
BNCBBGKFXUTDEJ-UHFFFAOYSA-NSynonyms
836651-77-511(13benzodioxol5yl)2methyl3(tetrahydrofuran2ylmethyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
11(benzo(d)(13)dioxol5yl)2methyl3((tetrahydrofuran2yl)methyl)3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
836651775
CC1=NC2=C(C3=NC4=CC=CC=C4N=C3N2C5=CC6=C(C=C5)OCO6)C(=O)N1CC7CCCO7
InChI=1SC25H21N5O4c114262321(25(31)29(14)121654103216)2224(2818732617(18)2722)30(23)15891920(1115)34133319h23691116H45101213H21H3
MFCD03692415
ZINC000002254037
ZINC000002254038
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