Vitas-M small molecule compound

3-(4-nitrophenyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyridine

Catalog ID
STL414685
SMILES [O-][N+](=O)c1ccc(cc1)c1nnc2n1CCCC2

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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 C12H12N4O2 MW 244.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12N4O2/c17-16(18)10-6-4-9(5-7-10)12-14-13-11-3-1-2-8-15(11)12/h4-7H,1-3,8H2
InChIKey
JGQJMPXZZWWZTP-UHFFFAOYSA-N
Synonyms
1245773-13-0
(O)(N+)(=O)c1ccc(cc1)c1nnc2n1CCCC2
1245773130
3(4NITROPHENYL)124TRIAZOLO(43A)PIPERIDINE
3(4nitrophenyl)5678tetrahydro(124)triazolo(43a)pyridine
C1CCN2C(=NN=C2C3=CC=C(C=C3)(N+)(=O)(O))C1
InChI=1SC12H12N4O2c1716(18)10649(5710)12141311312815(11)12h47H138H2
MFCD18374176
ZINC000072334188
ZINC72334188

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.