Vitas-M small molecule compound
4-bromo-2-{6-[(4-methoxyphenyl)amino]-10-methyl-8-(pyridin-2-yl)-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-11-yl}phenol
Catalog ID
STL409164
SMILES COc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2cc(Br)ccc2O)c(nn1c1ccccn1)C
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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 C31H24BrN7O2 MW 606.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H24BrN7O2/c1-18-27-28(22-17-19(32)10-15-25(22)40)38-24-8-4-3-7-23(24)35-29(34-20-11-13-21(41-2)14-12-20)31(38)36-30(27)39(37-18)26-9-5-6-16-33-26/h3-17,28,40H,1-2H3,(H,34,35)InChIKey
JUIUHBKHWOVSTL-UHFFFAOYSA-NSynonyms
4bromo2(6((4methoxyphenyl)amino)10methyl8(pyridin2yl)811dihydropyrazolo(3445)pyrimido(12a)quinoxalin11yl)phenol
CC1=NN(C2=C1C(N3C4=CC=CC=C4N=C(C3=N2)NC5=CC=C(C=C5)OC)C6=C(C=CC(=C6)Br)O)C7=CC=CC=N7
InChI=1SC31H24BrN7O2c1182728(221719(32)101525(22)40)3824843723(24)3529(3420111321(412)141220)31(38)3630(27)39(3718)26956163326h3172840H12H3(H3435)
MFCD03692878
ZINC000103562773
ZINC000103562776
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