Vitas-M small molecule compound
11-(3-acetylphenyl)-2-ethyl-3-(tetrahydrofuran-2-ylmethyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK990714
SMILES CCc1nc2n(c3cccc(c3)C(=O)C)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 C27H25N5O3 MW 467.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N5O3/c1-3-22-30-25-23(27(34)31(22)15-19-10-7-13-35-19)24-26(29-21-12-5-4-11-20(21)28-24)32(25)18-9-6-8-17(14-18)16(2)33/h4-6,8-9,11-12,14,19H,3,7,10,13,15H2,1-2H3InChIKey
GLCNULCZQJFDSK-UHFFFAOYSA-NSynonyms
11(3acetylphenyl)2ethyl3(tetrahydrofuran2ylmethyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
CCC1=NC2=C(C3=NC4=CC=CC=C4N=C3N2C5=CC=CC(=C5)C(=O)C)C(=O)N1CC6CCCO6
InChI=1SC27H25N5O3c1322302523(27(34)31(22)1519107133519)2426(292112541120(21)2824)32(25)1896817(1418)16(2)33h468911121419H37101315H212H3
MFCD07801655
ZINC000006150869
ZINC000006150872
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