Vitas-M small molecule compound
2-ethyl-11-(4-methylphenyl)-3-(prop-2-en-1-yl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STL238367
SMILES C=CCn1c(CC)nc2c(c1=O)c1nc3ccccc3nc1n2c1ccc(cc1)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 C24H21N5O MW 395.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21N5O/c1-4-14-28-19(5-2)27-22-20(24(28)30)21-23(26-18-9-7-6-8-17(18)25-21)29(22)16-12-10-15(3)11-13-16/h4,6-13H,1,5,14H2,2-3H3InChIKey
XPVKZJSVGGQHMN-UHFFFAOYSA-NSynonyms
2ethyl11(4methylphenyl)3(prop2en1yl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
3allyl2ethyl11(ptolyl)3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
CCC1=NC2=C(C3=NC4=CC=CC=C4N=C3N2C5=CC=C(C=C5)C)C(=O)N1CC=C
InChI=1SC24H21N5Oc14142819(52)272220(24(28)30)2123(2618976817(18)2521)29(22)16121015(3)111316h4613H1514H223H3
MFCD02982135
ZINC000002300028
ZINC02300028
ZINC2300028
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