Vitas-M small molecule compound
3-[1-(5-methyl-3-nitro-1H-pyrazol-1-yl)propyl]-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepine
Catalog ID
STL414570
SMILES CCC(c1nnc2n1CCCCC2)n1nc(cc1C)[N+](=O)[O-]
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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 C14H20N6O2 MW 304.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H20N6O2/c1-3-11(19-10(2)9-13(17-19)20(21)22)14-16-15-12-7-5-4-6-8-18(12)14/h9,11H,3-8H2,1-2H3InChIKey
JSKVSCVVCJSQMO-UHFFFAOYSA-NSynonyms
1245772-38-61245772386
3(1(5methyl3nitro1Hpyrazol1yl)propyl)6789tetrahydro5H(124)triazolo(43a)azepine
3(1(5methyl3nitropyrazol1yl)propyl)6789tetrahydro5H(124)triazolo(43a)azepine
CCC(C1=NN=C2N1CCCCC2)N3C(=CC(=N3)(N+)(=O)(O))C
CCC(c1nnc2n1CCCCC2)n1nc(cc1C)(N+)(=O)(O)
InChI=1SC14H20N6O2c1311(1910(2)913(1719)20(21)22)141615127546818(12)14h911H38H212H3
MFCD16345364
ZINC000072334174
ZINC000072334175
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Check stock on Vitas-MAvailable files
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