Vitas-M small molecule compound
3-(butan-2-yl)-11-(tetrahydrofuran-2-ylmethyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STL240393
SMILES CCC(n1cnc2c(c1=O)c1nc3ccccc3nc1n2CC1CCCO1)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 C21H23N5O2 MW 377.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N5O2/c1-3-13(2)26-12-22-19-17(21(26)27)18-20(25(19)11-14-7-6-10-28-14)24-16-9-5-4-8-15(16)23-18/h4-5,8-9,12-14H,3,6-7,10-11H2,1-2H3InChIKey
BUUDTUDKWXKGRK-UHFFFAOYSA-NSynonyms
847184-87-63(butan2yl)11(tetrahydrofuran2ylmethyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
3(secbutyl)11((tetrahydrofuran2yl)methyl)3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
847184876
CCC(C)N1C=NC2=C(C1=O)C3=NC4=CC=CC=C4N=C3N2CC5CCCO5
InChI=1SC21H23N5O2c1313(2)2612221917(21(26)27)1820(25(19)111476102814)2416954815(16)2318h45891214H3671011H212H3
MFCD04184825
ZINC000002404060
ZINC000002404063
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