Vitas-M small molecule compound
11-(4-ethoxyphenyl)-3-(prop-2-en-1-yl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK534431
SMILES CCOc1ccc(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 C23H19N5O2 MW 397.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19N5O2/c1-3-13-27-14-24-21-19(23(27)29)20-22(26-18-8-6-5-7-17(18)25-20)28(21)15-9-11-16(12-10-15)30-4-2/h3,5-12,14H,1,4,13H2,2H3InChIKey
BFRTTZMZQPXGLR-UHFFFAOYSA-NSynonyms
11(4ethoxyphenyl)3(prop2en1yl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
3allyl11(4ethoxyphenyl)3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
CCOC1=CC=C(C=C1)N2C3=C(C4=NC5=CC=CC=C5N=C42)C(=O)N(C=N3)CC=C
InChI=1SC23H19N5O2c13132714242119(23(27)29)2022(2618865717(18)2520)28(21)1591116(121015)3042h351214H1413H22H3
MFCD02991247
ZINC000004820083
ZINC04820083
ZINC4820083
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