Vitas-M small molecule compound
11-(2-methoxy-5-methylphenyl)-2-methyl-3-(3-methylbutyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK990512
SMILES COc1ccc(cc1n1c2nc(C)n(c(=O)c2c2c1nc1ccccc1n2)CCC(C)C)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 C26H27N5O2 MW 441.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N5O2/c1-15(2)12-13-30-17(4)27-24-22(26(30)32)23-25(29-19-9-7-6-8-18(19)28-23)31(24)20-14-16(3)10-11-21(20)33-5/h6-11,14-15H,12-13H2,1-5H3InChIKey
TYIYSCDXCPACNF-UHFFFAOYSA-NSynonyms
846584-07-411(2methoxy5methylphenyl)2methyl3(3methylbutyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
3isopentyl11(2methoxy5methylphenyl)2methyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
846584074
CC1=CC(=C(C=C1)OC)N2C3=C(C4=NC5=CC=CC=C5N=C42)C(=O)N(C(=N3)C)CCC(C)C
InChI=1SC26H27N5O2c115(2)12133017(4)272422(26(30)32)2325(2919976818(19)2823)31(24)201416(3)101121(20)335h6111415H1213H215H3
MFCD04175467
ZINC000008871127
ZINC08871127
ZINC8871127
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