Vitas-M small molecule compound
3-(2-chlorobenzyl)-11-(3,5-dimethoxyphenyl)-2-methyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STL225861
SMILES COc1cc(OC)cc(c1)n1c2nc(C)n(c(=O)c2c2c1nc1ccccc1n2)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 C28H22ClN5O3 MW 511.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22ClN5O3/c1-16-30-26-24(28(35)33(16)15-17-8-4-5-9-21(17)29)25-27(32-23-11-7-6-10-22(23)31-25)34(26)18-12-19(36-2)14-20(13-18)37-3/h4-14H,15H2,1-3H3InChIKey
ZWRHSOZEMNDBHB-UHFFFAOYSA-NSynonyms
836652-21-23(2chlorobenzyl)11(35dimethoxyphenyl)2methyl311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
3(2chlorobenzyl)11(35dimethoxyphenyl)2methyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
836652212
CC1=NC2=C(C3=NC4=CC=CC=C4N=C3N2C5=CC(=CC(=C5)OC)OC)C(=O)N1CC6=CC=CC=C6Cl
InChI=1SC28H22ClN5O3c116302624(28(35)33(16)1517845921(17)29)2527(322311761022(23)3125)34(26)181219(362)1420(1318)373h414H15H213H3
MFCD03692483
ZINC000002254117
ZINC02254117
ZINC2254117
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