Vitas-M small molecule compound
3-cyclopentyl-11-[2-(4-methoxyphenyl)ethyl]-2-methyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK920294
SMILES COc1ccc(cc1)CCn1c2nc3ccccc3nc2c2c1nc(C)n(c2=O)C1CCCC1
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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 C27H27N5O2 MW 453.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N5O2/c1-17-28-25-23(27(33)32(17)19-7-3-4-8-19)24-26(30-22-10-6-5-9-21(22)29-24)31(25)16-15-18-11-13-20(34-2)14-12-18/h5-6,9-14,19H,3-4,7-8,15-16H2,1-2H3InChIKey
FIHFKFIPUQEPHI-UHFFFAOYSA-NSynonyms
799839-75-13cyclopentyl11(2(4methoxyphenyl)ethyl)2methyl311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
3cyclopentyl11(4methoxyphenethyl)2methyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
799839751
CC1=NC2=C(C3=NC4=CC=CC=C4N=C3N2CCC5=CC=C(C=C5)OC)C(=O)N1C6CCCC6
InChI=1SC27H27N5O2c117282523(27(33)32(17)19734819)2426(30221065921(22)2924)31(25)161518111320(342)141218h5691419H34781516H212H3
MFCD03686092
ZINC000002247638
ZINC02247638
ZINC2247638
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