Vitas-M small molecule compound

11-(1,3-benzodioxol-5-ylmethyl)-3-benzyl-2-methyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one

Catalog ID
STL237735
SMILES Cc1nc2n(Cc3ccc4c(c3)OCO4)c3c(c2c(=O)n1Cc1ccccc1)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 C28H21N5O3 MW 475.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H21N5O3/c1-17-29-26-24(28(34)32(17)14-18-7-3-2-4-8-18)25-27(31-21-10-6-5-9-20(21)30-25)33(26)15-19-11-12-22-23(13-19)36-16-35-22/h2-13H,14-16H2,1H3
InChIKey
SEDOVGIWGDYFLN-UHFFFAOYSA-N
Synonyms
381707-94-4
11(13benzodioxol5ylmethyl)3benzyl2methyl311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
11(benzo(d)(13)dioxol5ylmethyl)3benzyl2methyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
381707944
CC1=NC2=C(C3=NC4=CC=CC=C4N=C3N2CC5=CC6=C(C=C5)OCO6)C(=O)N1CC7=CC=CC=C7
InChI=1SC28H21N5O3c117292624(28(34)32(17)14187324818)2527(31211065920(21)3025)33(26)151911122223(1319)36163522h213H1416H21H3
MFCD02997504
ZINC000002306823
ZINC02306823
ZINC2306823

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Available files

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