Vitas-M small molecule compound
11-(3,4-dimethoxyphenyl)-10-methyl-8-(pyridin-2-yl)-N-[3-(trifluoromethyl)phenyl]-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Catalog ID
STL406957
SMILES COc1ccc(cc1OC)C1c2c(C)nn(c2N=c2n1c1ccccc1nc2Nc1cccc(c1)C(F)(F)F)c1ccccn1
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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 C33H26F3N7O2 MW 609.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H26F3N7O2/c1-19-28-29(20-14-15-25(44-2)26(17-20)45-3)42-24-12-5-4-11-23(24)39-30(38-22-10-8-9-21(18-22)33(34,35)36)32(42)40-31(28)43(41-19)27-13-6-7-16-37-27/h4-18,29H,1-3H3,(H,38,39)InChIKey
CGXHPZLXPPDKFP-UHFFFAOYSA-NSynonyms
11(34dimethoxyphenyl)10methyl8(pyridin2yl)N(3(trifluoromethyl)phenyl)811dihydropyrazolo(3445)pyrimido(12a)quinoxalin6amine
CC1=NN(C2=C1C(N3C4=CC=CC=C4N=C(C3=N2)NC5=CC=CC(=C5)C(F)(F)F)C6=CC(=C(C=C6)OC)OC)C7=CC=CC=N7
InChI=1SC33H26F3N7O2c1192829(20141525(442)26(1720)453)422412541123(24)3930(3822108921(1822)33(3435)36)32(42)4031(28)43(4119)271367163727h41829H13H3(H3839)
MFCD03684335
ZINC000097999792
ZINC000097999793
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