Vitas-M small molecule compound
ethyl 4-[2-methyl-3-(4-methylbenzyl)-4-oxo-3,4-dihydro-11H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-11-yl]benzoate
Catalog ID
STL225875
SMILES CCOC(=O)c1ccc(cc1)n1c2nc(C)n(c(=O)c2c2c1nc1ccccc1n2)Cc1ccc(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 C30H25N5O3 MW 503.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H25N5O3/c1-4-38-30(37)21-13-15-22(16-14-21)35-27-25(26-28(35)33-24-8-6-5-7-23(24)32-26)29(36)34(19(3)31-27)17-20-11-9-18(2)10-12-20/h5-16H,4,17H2,1-3H3InChIKey
RQPMOVFBVJDQLV-UHFFFAOYSA-NSynonyms
799833-56-0799833560
CCOC(=O)C1=CC=C(C=C1)N2C3=C(C4=NC5=CC=CC=C5N=C42)C(=O)N(C(=N3)C)CC6=CC=C(C=C6)C
ethyl4(2methyl3(4methylbenzyl)4oxo34dihydro11Hpyrimido(5445)pyrrolo(23b)quinoxalin11yl)benzoate
ethyl4(2methyl3(4methylbenzyl)4oxo3Hpyrimido(5445)pyrrolo(23b)quinoxalin11(4H)yl)benzoate
InChI=1SC30H25N5O3c143830(37)21131522(161421)352725(2628(35)3324865723(24)3226)29(36)34(19(3)3127)172011918(2)101220h516H417H213H3
MFCD03684819
ZINC000002246470
ZINC02246470
ZINC2246470
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