Vitas-M small molecule compound

2-ethyl-3-(3-methylbutyl)-11-(3-methylphenyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one

Catalog ID
STK990678
SMILES CCc1nc2n(c3cccc(c3)C)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 C26H27N5O MW 425.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N5O/c1-5-21-29-24-22(26(32)30(21)14-13-16(2)3)23-25(28-20-12-7-6-11-19(20)27-23)31(24)18-10-8-9-17(4)15-18/h6-12,15-16H,5,13-14H2,1-4H3
InChIKey
VQVYRLUFSIELLT-UHFFFAOYSA-N
Synonyms

2ethyl3(3methylbutyl)11(3methylphenyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
CCC1=NC2=C(C3=NC4=CC=CC=C4N=C3N2C5=CC=CC(=C5)C)C(=O)N1CCC(C)C
InChI=1SC26H27N5Oc1521292422(26(32)30(21)141316(2)3)2325(282012761119(20)2723)31(24)18108917(4)1518h6121516H51314H214H3
MFCD05696136
ZINC000005021726
ZINC05021726
ZINC5021726

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Available files

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