Vitas-M small molecule compound
11-(4-chlorobenzyl)-3-cyclohexyl-2-ethyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK532999
SMILES CCc1nc2n(Cc3ccc(cc3)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 C27H26ClN5O MW 471.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26ClN5O/c1-2-22-31-25-23(27(34)33(22)19-8-4-3-5-9-19)24-26(30-21-11-7-6-10-20(21)29-24)32(25)16-17-12-14-18(28)15-13-17/h6-7,10-15,19H,2-5,8-9,16H2,1H3InChIKey
MLJLQFNUYGJBRI-UHFFFAOYSA-NSynonyms
11(4chlorobenzyl)3cyclohexyl2ethyl311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
11(4chlorobenzyl)3cyclohexyl2ethyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
CCC1=NC2=C(C3=NC4=CC=CC=C4N=C3N2CC5=CC=C(C=C5)Cl)C(=O)N1C6CCCCC6
InChI=1SC27H26ClN5Oc1222312523(27(34)33(22)198435919)2426(302111761020(21)2924)32(25)1617121418(28)151317h67101519H258916H21H3
MFCD02994775
ZINC000002302447
ZINC02302447
ZINC2302447
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