Vitas-M small molecule compound
11-(4-chloro-3-nitrophenyl)-3-cyclohexyl-2-methyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK551523
SMILES [O-][N+](=O)c1cc(ccc1Cl)n1c2nc3ccccc3nc2c2c1nc(C)n(c2=O)C1CCCCC1
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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 C25H21ClN6O3 MW 488.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21ClN6O3/c1-14-27-23-21(25(33)30(14)15-7-3-2-4-8-15)22-24(29-19-10-6-5-9-18(19)28-22)31(23)16-11-12-17(26)20(13-16)32(34)35/h5-6,9-13,15H,2-4,7-8H2,1H3InChIKey
IAVCCTCOODQMRL-UHFFFAOYSA-NSynonyms
799824-82-1(O)(N+)(=O)c1cc(ccc1Cl)n1c2nc3ccccc3nc2c2c1nc(C)n(c2=O)C1CCCCC1
11(4chloro3nitrophenyl)3cyclohexyl2methyl311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
11(4chloro3nitrophenyl)3cyclohexyl2methyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
799824821
CC1=NC2=C(C3=NC4=CC=CC=C4N=C3N2C5=CC(=C(C=C5)Cl)(N+)(=O)(O))C(=O)N1C6CCCCC6
InChI=1SC25H21ClN6O3c114272321(25(33)30(14)157324815)2224(29191065918(19)2822)31(23)16111217(26)20(1316)32(34)35h5691315H2478H21H3
MFCD03682828
ZINC000002238292
ZINC02238292
ZINC2238292
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