Vitas-M small molecule compound
11-(4-chloro-3-nitrophenyl)-3-cyclohexyl-2-ethyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK634730
SMILES CCc1nc2n(c3ccc(c(c3)[N+](=O)[O-])Cl)c3c(c2c(=O)n1C1CCCCC1)nc1c(n3)cccc1
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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 C26H23ClN6O3 MW 502.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23ClN6O3/c1-2-21-30-24-22(26(34)31(21)15-8-4-3-5-9-15)23-25(29-19-11-7-6-10-18(19)28-23)32(24)16-12-13-17(27)20(14-16)33(35)36/h6-7,10-15H,2-5,8-9H2,1H3InChIKey
PNMBQLSWDFAKJN-UHFFFAOYSA-NSynonyms
799787-40-911(4chloro3nitrophenyl)3cyclohexyl2ethyl311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
11(4chloro3nitrophenyl)3cyclohexyl2ethyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
799787409
CCC1=NC2=C(C3=NC4=CC=CC=C4N=C3N2C5=CC(=C(C=C5)Cl)(N+)(=O)(O))C(=O)N1C6CCCCC6
CCc1nc2n(c3ccc(c(c3)(N+)(=O)(O))Cl)c3c(c2c(=O)n1C1CCCCC1)nc1c(n3)cccc1
InChI=1SC26H23ClN6O3c1221302422(26(34)31(21)158435915)2325(291911761018(19)2823)32(24)16121317(27)20(1416)33(35)36h671015H2589H21H3
MFCD03675886
ZINC000009076575
ZINC09076575
ZINC9076575
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