Vitas-M small molecule compound
3-(2-chlorobenzyl)-11-(2,3-dihydro-1,4-benzodioxin-6-yl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STL236615
SMILES Clc1ccccc1Cn1cnc2c(c1=O)c1nc3ccccc3nc1n2c1ccc2c(c1)OCCO2
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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 C27H18ClN5O3 MW 495.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H18ClN5O3/c28-18-6-2-1-5-16(18)14-32-15-29-25-23(27(32)34)24-26(31-20-8-4-3-7-19(20)30-24)33(25)17-9-10-21-22(13-17)36-12-11-35-21/h1-10,13,15H,11-12,14H2InChIKey
DASMCJVJTQLEHJ-UHFFFAOYSA-NSynonyms
840457-24-13(2chlorobenzyl)11(23dihydro14benzodioxin6yl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
3(2chlorobenzyl)11(23dihydrobenzo(b)(14)dioxin6yl)3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
840457241
C1COC2=C(O1)C=CC(=C2)N3C4=C(C5=NC6=CC=CC=C6N=C53)C(=O)N(C=N4)CC7=CC=CC=C7Cl
InChI=1SC27H18ClN5O3c2818621516(18)143215292523(27(32)34)2426(3120843719(20)3024)33(25)179102122(1317)3612113521h1101315H111214H2
MFCD03694361
ZINC000002256691
ZINC02256691
ZINC2256691
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