Vitas-M small molecule compound
3-(4-chlorobenzyl)-11-(3,5-dimethoxyphenyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STL237912
SMILES COc1cc(OC)cc(c1)n1c2ncn(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 C27H20ClN5O3 MW 497.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H20ClN5O3/c1-35-19-11-18(12-20(13-19)36-2)33-25-23(24-26(33)31-22-6-4-3-5-21(22)30-24)27(34)32(15-29-25)14-16-7-9-17(28)10-8-16/h3-13,15H,14H2,1-2H3InChIKey
ZOGPDIBSGDMMMG-UHFFFAOYSA-NSynonyms
836638-23-43(4chlorobenzyl)11(35dimethoxyphenyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
3(4chlorobenzyl)11(35dimethoxyphenyl)3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
836638234
COC1=CC(=CC(=C1)N2C3=C(C4=NC5=CC=CC=C5N=C42)C(=O)N(C=N3)CC6=CC=C(C=C6)Cl)OC
InChI=1SC27H20ClN5O3c135191118(1220(1319)362)332523(2426(33)3122643521(22)3024)27(34)32(152925)14167917(28)10816h31315H14H212H3
MFCD03690071
ZINC000009462369
ZINC09462369
ZINC9462369
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