Vitas-M small molecule compound
2-ethyl-11-(4-methoxybenzyl)-3-pentyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK604146
SMILES CCCCCn1c(CC)nc2c(c1=O)c1nc3ccccc3nc1n2Cc1ccc(cc1)OC
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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/c1-4-6-9-16-31-22(5-2)30-25-23(27(31)33)24-26(29-21-11-8-7-10-20(21)28-24)32(25)17-18-12-14-19(34-3)15-13-18/h7-8,10-15H,4-6,9,16-17H2,1-3H3InChIKey
YXOIAQNVRCQLEN-UHFFFAOYSA-NSynonyms
2ethyl11(4methoxybenzyl)3pentyl311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
2ethyl11(4methoxybenzyl)3pentyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
CCCCCN1C(=NC2=C(C1=O)C3=NC4=CC=CC=C4N=C3N2CC5=CC=C(C=C5)OC)CC
InChI=1SC27H29N5O2c1469163122(52)302523(27(31)33)2426(292111871020(21)2824)32(25)1718121419(343)151318h781015H4691617H213H3
MFCD02987751
ZINC000009309943
ZINC09309943
ZINC9309943
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