Vitas-M small molecule compound

(3-amino-1H-1,2,4-triazol-1-yl)(3-nitrophenyl)methanone

Catalog ID
STK286103
SMILES Nc1ncn(n1)C(=O)c1cccc(c1)[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 C9H7N5O3 MW 233.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H7N5O3/c10-9-11-5-13(12-9)8(15)6-2-1-3-7(4-6)14(16)17/h1-5H,(H2,10,12)
InChIKey
NPXDAEZIARCUHI-UHFFFAOYSA-N
Synonyms
111544-24-2
(3AMINO124TRIAZOL1YL)(3NITROPHENYL)METHANONE
(3amino1H124triazol1yl)(3nitrophenyl)methanone
111544242
C1=CC(=CC(=C1)(N+)(=O)(O))C(=O)N2C=NC(=N2)N
InChI=1SC9H7N5O3c10911513(129)8(15)62137(46)14(16)17h15H(H21012)
MFCD03292836
Nc1ncn(n1)C(=O)c1cccc(c1)(N+)(=O)(O)
ZINC000000462446
ZINC00462446
ZINC462446

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Available files

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