Vitas-M small molecule compound
3-(4-chlorobenzyl)-11-(2-methoxybenzyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK990376
SMILES COc1ccccc1Cn1c2ncn(c(=O)c2c2c1nc1ccccc1n2)Cc1ccc(cc1)Cl
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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 C27H20ClN5O2 MW 481.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H20ClN5O2/c1-35-22-9-5-2-6-18(22)15-33-25-23(24-26(33)31-21-8-4-3-7-20(21)30-24)27(34)32(16-29-25)14-17-10-12-19(28)13-11-17/h2-13,16H,14-15H2,1H3InChIKey
ZDSQEEPLMHVACI-UHFFFAOYSA-NSynonyms
836641-75-93(4chlorobenzyl)11(2methoxybenzyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
3(4chlorobenzyl)11(2methoxybenzyl)3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
836641759
COC1=CC=CC=C1CN2C3=C(C4=NC5=CC=CC=C5N=C42)C(=O)N(C=N3)CC6=CC=C(C=C6)Cl
InChI=1SC27H20ClN5O2c13522952618(22)15332523(2426(33)3121843720(21)3024)27(34)32(162925)1417101219(28)131117h21316H1415H21H3
MFCD03690819
ZINC000002251883
ZINC02251883
ZINC2251883
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