Vitas-M small molecule compound
3-(butan-2-yl)-11-(4-butylphenyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STL225955
SMILES CCCCc1ccc(cc1)n1c2nc3ccccc3nc2c2c1ncn(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 C26H27N5O MW 425.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N5O/c1-4-6-9-18-12-14-19(15-13-18)31-24-22(26(32)30(16-27-24)17(3)5-2)23-25(31)29-21-11-8-7-10-20(21)28-23/h7-8,10-17H,4-6,9H2,1-3H3InChIKey
PVJJTDIMRWUSPN-UHFFFAOYSA-NSynonyms
845632-91-93(butan2yl)11(4butylphenyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
3(secbutyl)11(4butylphenyl)3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
845632919
CCCCC1=CC=C(C=C1)N2C3=C(C4=NC5=CC=CC=C5N=C42)C(=O)N(C=N3)C(C)CC
InChI=1SC26H27N5Oc146918121419(151318)312422(26(32)30(162724)17(3)52)2325(31)292111871020(21)2823h781017H469H213H3
MFCD04166966
ZINC000002413726
ZINC000002413727
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