Vitas-M small molecule compound
10-methyl-8-(pyridin-2-yl)-N-[3-(trifluoromethyl)phenyl]-11-(3,4,5-trimethoxyphenyl)-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-6-amine
Catalog ID
STL406958
SMILES COc1c(OC)cc(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 C34H28F3N7O3 MW 639.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H28F3N7O3/c1-19-28-29(20-16-25(45-2)30(47-4)26(17-20)46-3)43-24-13-6-5-12-23(24)40-31(39-22-11-9-10-21(18-22)34(35,36)37)33(43)41-32(28)44(42-19)27-14-7-8-15-38-27/h5-18,29H,1-4H3,(H,39,40)InChIKey
GPWIGPKEIYUKDE-UHFFFAOYSA-NSynonyms
10methyl8(pyridin2yl)N(3(trifluoromethyl)phenyl)11(345trimethoxyphenyl)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)OC)C7=CC=CC=N7
InChI=1SC34H28F3N7O3c1192829(201625(452)30(474)26(1720)463)432413651223(24)4031(39221191021(1822)34(3536)37)33(43)4132(28)44(4219)271478153827h51829H14H3(H3940)
MFCD03692610
ZINC000097999976
ZINC000097999977
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