Vitas-M small molecule compound

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

Catalog ID
STL241773
SMILES CCCCCCn1cnc2c(c1=O)c1nc3ccccc3nc1n2c1ccc(c(c1)Cl)C

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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 C25H24ClN5O MW 445.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24ClN5O/c1-3-4-5-8-13-30-15-27-23-21(25(30)32)22-24(29-20-10-7-6-9-19(20)28-22)31(23)17-12-11-16(2)18(26)14-17/h6-7,9-12,14-15H,3-5,8,13H2,1-2H3
InChIKey
CBVYJSPAJMYDBB-UHFFFAOYSA-N
Synonyms
845635-97-4
11(3chloro4methylphenyl)3hexyl311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
11(3chloro4methylphenyl)3hexyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
845635974
CCCCCCN1C=NC2=C(C1=O)C3=NC4=CC=CC=C4N=C3N2C5=CC(=C(C=C5)C)Cl
InChI=1SC25H24ClN5Oc13458133015272321(25(30)32)2224(29201076919(20)2822)31(23)17121116(2)18(26)1417h679121415H35813H212H3
MFCD04167155
ZINC000002413898
ZINC02413898
ZINC2413898

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Available files

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