Vitas-M small molecule compound
3-(2-chlorobenzyl)-11-[3-(trifluoromethyl)phenyl]-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STL225828
SMILES Clc1ccccc1Cn1cnc2c(c1=O)c1nc3ccccc3nc1n2c1cccc(c1)C(F)(F)F
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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 C26H15ClF3N5O MW 505.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H15ClF3N5O/c27-18-9-2-1-6-15(18)13-34-14-31-23-21(25(34)36)22-24(33-20-11-4-3-10-19(20)32-22)35(23)17-8-5-7-16(12-17)26(28,29)30/h1-12,14H,13H2InChIKey
OAHIBCNBUSUYKE-UHFFFAOYSA-NSynonyms
835909-85-83(2chlorobenzyl)11(3(trifluoromethyl)phenyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
3(2chlorobenzyl)11(3(trifluoromethyl)phenyl)3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
835909858
C1=CC=C(C(=C1)CN2C=NC3=C(C2=O)C4=NC5=CC=CC=C5N=C4N3C6=CC=CC(=C6)C(F)(F)F)Cl
InChI=1SC26H15ClF3N5Oc2718921615(18)133414312321(25(34)36)2224(332011431019(20)3222)35(23)1785716(1217)26(2829)30h11214H13H2
MFCD03687068
ZINC000002249365
ZINC02249365
ZINC2249365
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