Vitas-M small molecule compound
ethyl 4-[4-oxo-3-(prop-2-en-1-yl)-3,4-dihydro-11H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-11-yl]benzoate
Catalog ID
STK538246
SMILES CCOC(=O)c1ccc(cc1)n1c2nc3ccccc3nc2c2c1ncn(c2=O)CC=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 C24H19N5O3 MW 425.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19N5O3/c1-3-13-28-14-25-21-19(23(28)30)20-22(27-18-8-6-5-7-17(18)26-20)29(21)16-11-9-15(10-12-16)24(31)32-4-2/h3,5-12,14H,1,4,13H2,2H3InChIKey
WVVIRSIUXAKGNR-UHFFFAOYSA-NSynonyms
487018-24-6487018246
CCOC(=O)C1=CC=C(C=C1)N2C3=C(C4=NC5=CC=CC=C5N=C42)C(=O)N(C=N3)CC=C
ethyl4(3allyl4oxo3Hpyrimido(5445)pyrrolo(23b)quinoxalin11(4H)yl)benzoate
ethyl4(4oxo3(prop2en1yl)34dihydro11Hpyrimido(5445)pyrrolo(23b)quinoxalin11yl)benzoate
InChI=1SC24H19N5O3c13132814252119(23(28)30)2022(2718865717(18)2620)29(21)1611915(101216)24(31)3242h351214H1413H22H3
MFCD02999851
ZINC000002310373
ZINC02310373
ZINC2310373
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