Vitas-M small molecule compound
3-(4-chlorobenzyl)-11-[3-(trifluoromethyl)phenyl]-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK714124
SMILES Clc1ccc(cc1)Cn1cnc2c(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/c27-17-10-8-15(9-11-17)13-34-14-31-23-21(25(34)36)22-24(33-20-7-2-1-6-19(20)32-22)35(23)18-5-3-4-16(12-18)26(28,29)30/h1-12,14H,13H2InChIKey
HOIMZDMCSIETKM-UHFFFAOYSA-NSynonyms
836650-72-73(4chlorobenzyl)11(3(trifluoromethyl)phenyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
3(4chlorobenzyl)11(3(trifluoromethyl)phenyl)3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
836650727
C1=CC=C2C(=C1)N=C3C4=C(N=CN(C4=O)CC5=CC=C(C=C5)Cl)N(C3=N2)C6=CC=CC(=C6)C(F)(F)F
InChI=1SC26H15ClF3N5Oc271710815(91117)133414312321(25(34)36)2224(3320721619(20)3222)35(23)1853416(1218)26(2829)30h11214H13H2
MFCD03692154
ZINC000002253812
ZINC02253812
ZINC2253812
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