Vitas-M small molecule compound
ethyl 4-[3-(butan-2-yl)-2-methyl-4-oxo-3,4-dihydro-11H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-11-yl]benzoate
Catalog ID
STK920413
SMILES CCOC(=O)c1ccc(cc1)n1c2nc3ccccc3nc2c2c1nc(C)n(c2=O)C(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 C26H25N5O3 MW 455.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N5O3/c1-5-15(3)30-16(4)27-23-21(25(30)32)22-24(29-20-10-8-7-9-19(20)28-22)31(23)18-13-11-17(12-14-18)26(33)34-6-2/h7-15H,5-6H2,1-4H3InChIKey
CPERZUFLBGXHCG-UHFFFAOYSA-NSynonyms
846597-40-8846597408
CCC(C)N1C(=NC2=C(C1=O)C3=NC4=CC=CC=C4N=C3N2C5=CC=C(C=C5)C(=O)OCC)C
ethyl4(3(butan2yl)2methyl4oxo34dihydro11Hpyrimido(5445)pyrrolo(23b)quinoxalin11yl)benzoate
ethyl4(3(secbutyl)2methyl4oxo3Hpyrimido(5445)pyrrolo(23b)quinoxalin11(4H)yl)benzoate
InChI=1SC26H25N5O3c1515(3)3016(4)272321(25(30)32)2224(29201087919(20)2822)31(23)18131117(121418)26(33)3462h715H56H214H3
MFCD04176719
ZINC000002404687
ZINC000002404688
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