Vitas-M small molecule compound
11-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-ethyl-3-(3-methylbutyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK714363
SMILES CCc1nc2n(c3ccc4c(c3)OCCO4)c3c(c2c(=O)n1CCC(C)C)nc1c(n3)cccc1
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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 C27H27N5O3 MW 469.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N5O3/c1-4-22-30-25-23(27(33)31(22)12-11-16(2)3)24-26(29-19-8-6-5-7-18(19)28-24)32(25)17-9-10-20-21(15-17)35-14-13-34-20/h5-10,15-16H,4,11-14H2,1-3H3InChIKey
HFDSABJGMJONSA-UHFFFAOYSA-NSynonyms
850722-17-711(23dihydro14benzodioxin6yl)2ethyl3(3methylbutyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
11(23dihydrobenzo(b)(14)dioxin6yl)2ethyl3isopentyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
850722177
CCC1=NC2=C(C3=NC4=CC=CC=C4N=C3N2C5=CC6=C(C=C5)OCCO6)C(=O)N1CCC(C)C
InChI=1SC27H27N5O3c1422302523(27(33)31(22)121116(2)3)2426(2919865718(19)2824)32(25)179102021(1517)3514133420h5101516H41114H213H3
MFCD05692688
ZINC000002395392
ZINC02395392
ZINC2395392
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