Vitas-M small molecule compound
11-(5-chloro-2-methylphenyl)-3-cyclopentyl-2-methyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STL159528
SMILES Clc1ccc(c(c1)n1c2nc3ccccc3nc2c2c1nc(C)n(c2=O)C1CCCC1)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 C25H22ClN5O MW 443.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22ClN5O/c1-14-11-12-16(26)13-20(14)31-23-21(22-24(31)29-19-10-6-5-9-18(19)28-22)25(32)30(15(2)27-23)17-7-3-4-8-17/h5-6,9-13,17H,3-4,7-8H2,1-2H3InChIKey
UHOOYNSRECWTKW-UHFFFAOYSA-NSynonyms
840457-38-711(5chloro2methylphenyl)3cyclopentyl2methyl311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
11(5chloro2methylphenyl)3cyclopentyl2methyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
840457387
CC1=C(C=C(C=C1)Cl)N2C3=C(C4=NC5=CC=CC=C5N=C42)C(=O)N(C(=N3)C)C6CCCC6
InChI=1SC25H22ClN5Oc114111216(26)1320(14)312321(2224(31)29191065918(19)2822)25(32)30(15(2)2723)17734817h5691317H3478H212H3
MFCD03694392
ZINC000002256724
ZINC02256724
ZINC2256724
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