Vitas-M small molecule compound
11-(4-ethoxyphenyl)-2-methyl-3-(3-methylbutyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STL237868
SMILES CCOc1ccc(cc1)n1c2nc3ccccc3nc2c2c1nc(C)n(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/c1-5-33-19-12-10-18(11-13-19)31-24-22(26(32)30(17(4)27-24)15-14-16(2)3)23-25(31)29-21-9-7-6-8-20(21)28-23/h6-13,16H,5,14-15H2,1-4H3InChIKey
VOWKHNPDQXCQCH-UHFFFAOYSA-NSynonyms
844661-95-611(4ethoxyphenyl)2methyl3(3methylbutyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
11(4ethoxyphenyl)3isopentyl2methyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
844661956
CCOC1=CC=C(C=C1)N2C3=C(C4=NC5=CC=CC=C5N=C42)C(=O)N(C(=N3)C)CCC(C)C
InChI=1SC26H27N5O2c153319121018(111319)312422(26(32)30(17(4)2724)151416(2)3)2325(31)2921976820(21)2823h61316H51415H214H3
MFCD04160016
ZINC000002405157
ZINC02405157
ZINC2405157
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