Vitas-M small molecule compound

2-{1-[(2-bromo-4-chlorophenoxy)methyl]-1H-pyrazol-3-yl}-7-methyl-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine

Catalog ID
STK309985
SMILES Clc1ccc(c(c1)Br)OCn1ccc(n1)c1nn2c(n1)c1cnn(c1nc2)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 C17H12BrClN8O MW 459.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12BrClN8O/c1-25-16-11(7-21-25)17-22-15(24-27(17)8-20-16)13-4-5-26(23-13)9-28-14-3-2-10(19)6-12(14)18/h2-8H,9H2,1H3
InChIKey
OATSIGNMWHNNCB-UHFFFAOYSA-N
Synonyms
1005652-65-2
1005652652
2(1((2bromo4chlorophenoxy)methyl)1Hpyrazol3yl)7methyl7Hpyrazolo(43e)(124)triazolo(15c)pyrimidine
CN1C2=C(C=N1)C3=NC(=NN3C=N2)C4=NN(C=C4)COC5=C(C=C(C=C5)Cl)Br
InChI=1SC17H12BrClN8Oc1251611(72125)172215(2427(17)82016)134526(2313)928143210(19)612(14)18h28H9H21H3
MFCD04134564
ZINC000002803844
ZINC02803844
ZINC2803844

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Available files

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