Vitas-M small molecule compound
N-(3-methoxyphenyl)-5-(4-nitro-1H-pyrazol-5-yl)-4H-1,2,4-triazol-3-amine
Catalog ID
STK783209
SMILES COc1cccc(c1)Nc1nnc([nH]1)c1[nH]ncc1[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 C12H11N7O3 MW 301.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H11N7O3/c1-22-8-4-2-3-7(5-8)14-12-15-11(17-18-12)10-9(19(20)21)6-13-16-10/h2-6H,1H3,(H,13,16)(H2,14,15,17,18)InChIKey
LTAVUEJZIJUPRS-UHFFFAOYSA-NSynonyms
(3METHOXYPHENYL)(5(4NITROPYRAZOL5YL)(4H124TRIAZOL3YL))AMINE
4H124TRIAZOL3AMINEN(3METHOXYPHENYL)5(4NITRO1HPYRAZOL5YL)
COC1=CC=CC(=C1)NC2=NNC(=N2)C3=C(C=NN3)(N+)(=O)(O)
COc1cccc(c1)Nc1nnc((nH)1)c1(nH)ncc1(N+)(=O)(O)
InChI=1SC12H11N7O3c12284237(58)14121511(171812)109(19(20)21)6131610h26H1H3(H1316)(H214151718)
MFCD06617787
N(3METHOXYPHENYL)5(4NITRO1HPYRAZOL5YL)1H124TRIAZOL3AMINE
N(3methoxyphenyl)5(4nitro1Hpyrazol5yl)4H124triazol3amine
ZINC000004625956
ZINC04625956
ZINC4625956
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