Vitas-M small molecule compound
2-ethyl-3-hexyl-11-(4-methoxyphenyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK714274
SMILES CCCCCCn1c(CC)nc2c(c1=O)c1nc3ccccc3nc1n2c1ccc(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/c1-4-6-7-10-17-31-22(5-2)30-25-23(27(31)33)24-26(29-21-12-9-8-11-20(21)28-24)32(25)18-13-15-19(34-3)16-14-18/h8-9,11-16H,4-7,10,17H2,1-3H3InChIKey
DFALTBNBGFGDRI-UHFFFAOYSA-NSynonyms
2ethyl3hexyl11(4methoxyphenyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
2ethyl3hexyl11(4methoxyphenyl)3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
CCCCCCN1C(=NC2=C(C1=O)C3=NC4=CC=CC=C4N=C3N2C5=CC=C(C=C5)OC)CC
InChI=1SC27H29N5O2c146710173122(52)302523(27(31)33)2426(292112981120(21)2824)32(25)18131519(343)161418h891116H471017H213H3
MFCD02992259
ZINC000002287909
ZINC02287909
ZINC2287909
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