Vitas-M small molecule compound

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

Catalog ID
STK714152
SMILES Clc1ccc(cc1)Cn1c2nc3ccccc3nc2c2c1nc(C)n(c2=O)Cc1ccccc1Cl

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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 C27H19Cl2N5O MW 500.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H19Cl2N5O/c1-16-30-25-23(27(35)33(16)15-18-6-2-3-7-20(18)29)24-26(32-22-9-5-4-8-21(22)31-24)34(25)14-17-10-12-19(28)13-11-17/h2-13H,14-15H2,1H3
InChIKey
OLECGRRKLDPWAF-UHFFFAOYSA-N
Synonyms
799831-07-5
3(2chlorobenzyl)11(4chlorobenzyl)2methyl311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
3(2chlorobenzyl)11(4chlorobenzyl)2methyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
799831075
CC1=NC2=C(C3=NC4=CC=CC=C4N=C3N2CC5=CC=C(C=C5)Cl)C(=O)N1CC6=CC=CC=C6Cl
InChI=1SC27H19Cl2N5Oc116302523(27(35)33(16)1518623720(18)29)2426(3222954821(22)3124)34(25)1417101219(28)131117h213H1415H21H3
MFCD03684231
ZINC000002245818
ZINC02245818
ZINC2245818

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Available files

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