Vitas-M small molecule compound
3-(4-chlorobenzyl)-11-octyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK920212
SMILES CCCCCCCCn1c2ncn(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 C27H28ClN5O MW 474.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28ClN5O/c1-2-3-4-5-6-9-16-33-25-23(24-26(33)31-22-11-8-7-10-21(22)30-24)27(34)32(18-29-25)17-19-12-14-20(28)15-13-19/h7-8,10-15,18H,2-6,9,16-17H2,1H3InChIKey
IEBIOWKMZXTFEA-UHFFFAOYSA-NSynonyms
799838-61-23(4chlorobenzyl)11octyl311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
3(4chlorobenzyl)11octyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
799838612
CCCCCCCCN1C2=C(C3=NC4=CC=CC=C4N=C31)C(=O)N(C=N2)CC5=CC=C(C=C5)Cl
InChI=1SC27H28ClN5Oc123456916332523(2426(33)312211871021(22)3024)27(34)32(182925)1719121420(28)151319h78101518H2691617H21H3
MFCD03685838
ZINC000002247391
ZINC2247391
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