Vitas-M small molecule compound
2-ethyl-11-hexyl-3-(2-phenylethyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK551274
SMILES CCCCCCn1c2nc(CC)n(c(=O)c2c2c1nc1ccccc1n2)CCc1ccccc1
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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 C28H31N5O MW 453.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31N5O/c1-3-5-6-12-18-33-26-24(25-27(33)30-22-16-11-10-15-21(22)29-25)28(34)32(23(4-2)31-26)19-17-20-13-8-7-9-14-20/h7-11,13-16H,3-6,12,17-19H2,1-2H3InChIKey
RYLSVIXIXVHPIH-UHFFFAOYSA-NSynonyms
799809-93-12ethyl11hexyl3(2phenylethyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
2ethyl11hexyl3phenethyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
799809931
CCCCCCN1C2=C(C3=NC4=CC=CC=C4N=C31)C(=O)N(C(=N2)CC)CCC5=CC=CC=C5
InChI=1SC28H31N5Oc13561218332624(2527(33)30221611101521(22)2925)28(34)32(23(42)3126)191720138791420h7111316H36121719H212H3
MFCD03680260
ZINC000002231300
ZINC02231300
ZINC2231300
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