Vitas-M small molecule compound
2-ethyl-3-hexyl-11-(4-methoxybenzyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK714240
SMILES CCCCCCn1c(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 C28H31N5O2 MW 469.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31N5O2/c1-4-6-7-10-17-32-23(5-2)31-26-24(28(32)34)25-27(30-22-12-9-8-11-21(22)29-25)33(26)18-19-13-15-20(35-3)16-14-19/h8-9,11-16H,4-7,10,17-18H2,1-3H3InChIKey
WVVLOOKYTVJTHF-UHFFFAOYSA-NSynonyms
2ethyl3hexyl11(4methoxybenzyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
2ethyl3hexyl11(4methoxybenzyl)3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
CCCCCCN1C(=NC2=C(C1=O)C3=NC4=CC=CC=C4N=C3N2CC5=CC=C(C=C5)OC)CC
InChI=1SC28H31N5O2c146710173223(52)312624(28(32)34)2527(302212981121(22)2925)33(26)1819131520(353)161419h891116H47101718H213H3
MFCD02993056
ZINC000002298339
ZINC02298339
ZINC2298339
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