Vitas-M small molecule compound
11-[2-(4-methoxyphenyl)ethyl]-3-(3-methylbutyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK990500
SMILES COc1ccc(cc1)CCn1c2nc3ccccc3nc2c2c1ncn(c2=O)CCC(C)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 C26H27N5O2 MW 441.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N5O2/c1-17(2)12-14-30-16-27-24-22(26(30)32)23-25(29-21-7-5-4-6-20(21)28-23)31(24)15-13-18-8-10-19(33-3)11-9-18/h4-11,16-17H,12-15H2,1-3H3InChIKey
SJUILCPRNPMXLX-UHFFFAOYSA-NSynonyms
846581-00-811(2(4methoxyphenyl)ethyl)3(3methylbutyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
3isopentyl11(4methoxyphenethyl)3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
846581008
CC(C)CCN1C=NC2=C(C1=O)C3=NC4=CC=CC=C4N=C3N2CCC5=CC=C(C=C5)OC
InChI=1SC26H27N5O2c117(2)12143016272422(26(30)32)2325(2921754620(21)2823)31(24)15131881019(333)11918h4111617H1215H213H3
MFCD04177277
ZINC000002412282
ZINC02412282
ZINC2412282
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