Vitas-M small molecule compound
11-[2-(4-methoxyphenyl)ethyl]-2-methyl-3-(3-methylbutyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK990537
SMILES COc1ccc(cc1)CCn1c2nc3ccccc3nc2c2c1nc(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 C27H29N5O2 MW 455.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N5O2/c1-17(2)13-15-31-18(3)28-25-23(27(31)33)24-26(30-22-8-6-5-7-21(22)29-24)32(25)16-14-19-9-11-20(34-4)12-10-19/h5-12,17H,13-16H2,1-4H3InChIKey
MAVFRKSBWKNXPL-UHFFFAOYSA-NSynonyms
846065-28-911(2(4methoxyphenyl)ethyl)2methyl3(3methylbutyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
3isopentyl11(4methoxyphenethyl)2methyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
846065289
CC1=NC2=C(C3=NC4=CC=CC=C4N=C3N2CCC5=CC=C(C=C5)OC)C(=O)N1CCC(C)C
InChI=1SC27H29N5O2c117(2)13153118(3)282523(27(31)33)2426(3022865721(22)2924)32(25)16141991120(344)121019h51217H1316H214H3
MFCD04174024
ZINC000002429596
ZINC02429596
ZINC2429596
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