Vitas-M small molecule compound
3-(1,3-benzodioxol-5-ylmethyl)-11-(3-chlorophenyl)-2-ethyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STL152094
SMILES CCc1nc2n(c3cccc(c3)Cl)c3c(c2c(=O)n1Cc1ccc2c(c1)OCO2)nc1c(n3)cccc1
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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 C28H20ClN5O3 MW 509.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H20ClN5O3/c1-2-23-32-26-24(28(35)33(23)14-16-10-11-21-22(12-16)37-15-36-21)25-27(31-20-9-4-3-8-19(20)30-25)34(26)18-7-5-6-17(29)13-18/h3-13H,2,14-15H2,1H3InChIKey
VQUZVODFPIGLHD-UHFFFAOYSA-NSynonyms
380879-10-73(13benzodioxol5ylmethyl)11(3chlorophenyl)2ethyl311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
3(benzo(d)(13)dioxol5ylmethyl)11(3chlorophenyl)2ethyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
380879107
CCC1=NC2=C(C3=NC4=CC=CC=C4N=C3N2C5=CC(=CC=C5)Cl)C(=O)N1CC6=CC7=C(C=C6)OCO7
InChI=1SC28H20ClN5O3c1223322624(28(35)33(23)141610112122(1216)37153621)2527(3120943819(20)3025)34(26)1875617(29)1318h313H21415H21H3
MFCD02991813
ZINC000002435176
ZINC02435176
ZINC2435176
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