Vitas-M small molecule compound
11-(4-butylphenyl)-2-methyl-3-(tetrahydrofuran-2-ylmethyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK552462
SMILES CCCCc1ccc(cc1)n1c2nc3ccccc3nc2c2c1nc(C)n(c2=O)CC1CCCO1
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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 C28H29N5O2 MW 467.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29N5O2/c1-3-4-8-19-12-14-20(15-13-19)33-26-24(25-27(33)31-23-11-6-5-10-22(23)30-25)28(34)32(18(2)29-26)17-21-9-7-16-35-21/h5-6,10-15,21H,3-4,7-9,16-17H2,1-2H3InChIKey
KZRGVGTXOSBQJD-UHFFFAOYSA-NSynonyms
799782-63-111(4butylphenyl)2methyl3((tetrahydrofuran2yl)methyl)3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
11(4butylphenyl)2methyl3(tetrahydrofuran2ylmethyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
799782631
CCCCC1=CC=C(C=C1)N2C3=C(C4=NC5=CC=CC=C5N=C42)C(=O)N(C(=N3)C)CC6CCCO6
InChI=1SC28H29N5O2c134819121420(151319)332624(2527(33)312311651022(23)3025)28(34)32(18(2)2926)172197163521h56101521H34791617H212H3
MFCD03674489
ZINC000002212880
ZINC000008744520
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