Vitas-M small molecule compound

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

Catalog ID
STK990401
SMILES Clc1ccccc1Cn1c(C)nc2c(c1=O)c1nc3ccccc3nc1n2c1ccccc1C

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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 C27H20ClN5O MW 465.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H20ClN5O/c1-16-9-3-8-14-22(16)33-25-23(24-26(33)31-21-13-7-6-12-20(21)30-24)27(34)32(17(2)29-25)15-18-10-4-5-11-19(18)28/h3-14H,15H2,1-2H3
InChIKey
KJZMYWVHNGSTLK-UHFFFAOYSA-N
Synonyms
836626-61-0
3(2chlorobenzyl)2methyl11(2methylphenyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
3(2chlorobenzyl)2methyl11(otolyl)3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
836626610
CC1=CC=CC=C1N2C3=C(C4=NC5=CC=CC=C5N=C42)C(=O)N(C(=N3)C)CC6=CC=CC=C6Cl
InChI=1SC27H20ClN5Oc1169381422(16)332523(2426(33)312113761220(21)3024)27(34)32(17(2)2925)151810451119(18)28h314H15H212H3
MFCD03688328
ZINC000008836755
ZINC08836755
ZINC8836755

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Available files

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