Vitas-M small molecule compound

2-[2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)ethyl]-7-phenyl-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine

Catalog ID
STL400768
SMILES [O-][N+](=O)c1c(C)nn(c1C)CCc1nn2c(n1)c1cnn(c1nc2)c1ccccc1

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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 C19H17N9O2 MW 403.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17N9O2/c1-12-17(28(29)30)13(2)25(23-12)9-8-16-22-19-15-10-21-27(14-6-4-3-5-7-14)18(15)20-11-26(19)24-16/h3-7,10-11H,8-9H2,1-2H3
InChIKey
GBCBXDUEIWGFKG-UHFFFAOYSA-N
Synonyms
1005634-45-6
(O)(N+)(=O)c1c(C)nn(c1C)CCc1nn2c(n1)c1cnn(c1nc2)c1ccccc1
1005634456
2(2(35dimethyl4nitro1Hpyrazol1yl)ethyl)7phenyl7Hpyrazolo(43e)(124)triazolo(15c)pyrimidine
CC1=C(C(=NN1CCC2=NN3C=NC4=C(C3=N2)C=NN4C5=CC=CC=C5)C)(N+)(=O)(O)
InChI=1SC19H17N9O2c11217(28(29)30)13(2)25(2312)9816221915102127(146435714)18(15)201126(19)2416h371011H89H212H3
MFCD04051664
ZINC000002800179
ZINC02800179
ZINC2800179

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Available files

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