Vitas-M small molecule compound
11-(4-bromophenyl)-2-ethyl-3-(prop-2-en-1-yl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK603286
SMILES C=CCn1c(CC)nc2c(c1=O)c1nc3ccccc3nc1n2c1ccc(cc1)Br
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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 C23H18BrN5O MW 460.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18BrN5O/c1-3-13-28-18(4-2)27-21-19(23(28)30)20-22(26-17-8-6-5-7-16(17)25-20)29(21)15-11-9-14(24)10-12-15/h3,5-12H,1,4,13H2,2H3InChIKey
ZBVIXQFOXVTYMG-UHFFFAOYSA-NSynonyms
11(4bromophenyl)2ethyl3(prop2en1yl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
3allyl11(4bromophenyl)2ethyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
CCC1=NC2=C(C3=NC4=CC=CC=C4N=C3N2C5=CC=C(C=C5)Br)C(=O)N1CC=C
InChI=1SC23H18BrN5Oc13132818(42)272119(23(28)30)2022(2617865716(17)2520)29(21)1511914(24)101215h3512H1413H22H3
MFCD02983970
ZINC000008738168
ZINC08738168
ZINC8738168
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