Vitas-M small molecule compound
ethyl 4-[3-(2-chlorobenzyl)-4-oxo-3,4-dihydro-11H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-11-yl]benzoate
Catalog ID
STL239634
SMILES CCOC(=O)c1ccc(cc1)n1c2nc3ccccc3nc2c2c1ncn(c2=O)Cc1ccccc1Cl
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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 C28H20ClN5O3 MW 509.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H20ClN5O3/c1-2-37-28(36)17-11-13-19(14-12-17)34-25-23(24-26(34)32-22-10-6-5-9-21(22)31-24)27(35)33(16-30-25)15-18-7-3-4-8-20(18)29/h3-14,16H,2,15H2,1H3InChIKey
DYWCXKGWWPTKND-UHFFFAOYSA-NSynonyms
799836-60-5799836605
CCOC(=O)C1=CC=C(C=C1)N2C3=C(C4=NC5=CC=CC=C5N=C42)C(=O)N(C=N3)CC6=CC=CC=C6Cl
ethyl4(3(2chlorobenzyl)4oxo34dihydro11Hpyrimido(5445)pyrrolo(23b)quinoxalin11yl)benzoate
ethyl4(3(2chlorobenzyl)4oxo3Hpyrimido(5445)pyrrolo(23b)quinoxalin11(4H)yl)benzoate
InChI=1SC28H20ClN5O3c123728(36)17111319(141217)342523(2426(34)32221065921(22)3124)27(35)33(163025)1518734820(18)29h31416H215H21H3
MFCD03685352
ZINC000002246965
ZINC02246965
ZINC2246965
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