Vitas-M small molecule compound
ethyl 3-[3-(4-methylbenzyl)-4-oxo-3,4-dihydro-11H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-11-yl]benzoate
Catalog ID
STK920247
SMILES CCOC(=O)c1cccc(c1)n1c2nc3ccccc3nc2c2c1ncn(c2=O)Cc1ccc(cc1)C
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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/c1-3-37-29(36)20-7-6-8-21(15-20)34-26-24(25-27(34)32-23-10-5-4-9-22(23)31-25)28(35)33(17-30-26)16-19-13-11-18(2)12-14-19/h4-15,17H,3,16H2,1-2H3InChIKey
OTQSVKFBJKAICB-UHFFFAOYSA-NSynonyms
799830-26-5799830265
CCOC(=O)C1=CC(=CC=C1)N2C3=C(C4=NC5=CC=CC=C5N=C42)C(=O)N(C=N3)CC6=CC=C(C=C6)C
ethyl3(3(4methylbenzyl)4oxo34dihydro11Hpyrimido(5445)pyrrolo(23b)quinoxalin11yl)benzoate
ethyl3(3(4methylbenzyl)4oxo3Hpyrimido(5445)pyrrolo(23b)quinoxalin11(4H)yl)benzoate
InChI=1SC29H23N5O3c133729(36)2076821(1520)342624(2527(34)32231054922(23)3125)28(35)33(173026)1619131118(2)121419h41517H316H212H3
MFCD03684063
ZINC000002245647
ZINC02245647
ZINC2245647
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