Vitas-M small molecule compound
3-(2-chlorobenzyl)-11-[2-(3,4-dimethoxyphenyl)ethyl]-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STL225835
SMILES COc1ccc(cc1OC)CCn1c2nc3ccccc3nc2c2c1ncn(c2=O)Cc1ccccc1Cl
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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 C29H24ClN5O3 MW 525.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H24ClN5O3/c1-37-23-12-11-18(15-24(23)38-2)13-14-35-27-25(26-28(35)33-22-10-6-5-9-21(22)32-26)29(36)34(17-31-27)16-19-7-3-4-8-20(19)30/h3-12,15,17H,13-14,16H2,1-2H3InChIKey
FMOSJRGYEUUFAO-UHFFFAOYSA-NSynonyms
836633-72-83(2chlorobenzyl)11(2(34dimethoxyphenyl)ethyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
3(2chlorobenzyl)11(34dimethoxyphenethyl)3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
836633728
COC1=C(C=C(C=C1)CCN2C3=C(C4=NC5=CC=CC=C5N=C42)C(=O)N(C=N3)CC6=CC=CC=C6Cl)OC
InChI=1SC29H24ClN5O3c13723121118(1524(23)382)1314352725(2628(35)33221065921(22)3226)29(36)34(173127)1619734820(19)30h3121517H131416H212H3
MFCD03689310
ZINC000097952353
ZINC97952353
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