Vitas-M small molecule compound
11-(2,5-dimethoxyphenyl)-2-methyl-3-(3-methylbutyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK990506
SMILES COc1ccc(cc1n1c2nc3ccccc3nc2c2c1nc(C)n(c2=O)CCC(C)C)OC
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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 C26H27N5O3 MW 457.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N5O3/c1-15(2)12-13-30-16(3)27-24-22(26(30)32)23-25(29-19-9-7-6-8-18(19)28-23)31(24)20-14-17(33-4)10-11-21(20)34-5/h6-11,14-15H,12-13H2,1-5H3InChIKey
COXCRIARTMFQKJ-UHFFFAOYSA-NSynonyms
846596-33-611(25dimethoxyphenyl)2methyl3(3methylbutyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
11(25dimethoxyphenyl)3isopentyl2methyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
846596336
CC1=NC2=C(C3=NC4=CC=CC=C4N=C3N2C5=C(C=CC(=C5)OC)OC)C(=O)N1CCC(C)C
InChI=1SC26H27N5O3c115(2)12133016(3)272422(26(30)32)2325(2919976818(19)2823)31(24)201417(334)101121(20)345h6111415H1213H215H3
MFCD04176551
ZINC000002404522
ZINC02404522
ZINC2404522
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