Vitas-M small molecule compound
2-ethyl-11-(4-ethylphenyl)-3-(prop-2-en-1-yl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STL330541
SMILES C=CCn1c(CC)nc2c(c1=O)c1nc3ccccc3nc1n2c1ccc(cc1)CC
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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 C25H23N5O MW 409.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N5O/c1-4-15-29-20(6-3)28-23-21(25(29)31)22-24(27-19-10-8-7-9-18(19)26-22)30(23)17-13-11-16(5-2)12-14-17/h4,7-14H,1,5-6,15H2,2-3H3InChIKey
ALCXVBLWVHKWPC-UHFFFAOYSA-NSynonyms
2ethyl11(4ethylphenyl)3(prop2en1yl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
3allyl2ethyl11(4ethylphenyl)3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
CCC1=CC=C(C=C1)N2C3=C(C4=NC5=CC=CC=C5N=C42)C(=O)N(C(=N3)CC)CC=C
InChI=1SC25H23N5Oc14152920(63)282321(25(29)31)2224(27191087918(19)2622)30(23)17131116(52)121417h4714H15615H223H3
MFCD02996013
ZINC000002304615
ZINC02304615
ZINC2304615
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