Vitas-M small molecule compound

N-[3-(3-methylphenoxy)-5-nitrophenyl]-2-(3-nitro-1H-1,2,4-triazol-1-yl)acetamide

Catalog ID
STK342654
SMILES Cc1cccc(c1)Oc1cc(NC(=O)Cn2cnc(n2)[N+](=O)[O-])cc(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 C17H14N6O6 MW 398.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14N6O6/c1-11-3-2-4-14(5-11)29-15-7-12(6-13(8-15)22(25)26)19-16(24)9-21-10-18-17(20-21)23(27)28/h2-8,10H,9H2,1H3,(H,19,24)
InChIKey
XHOYPAKCFYMKRW-UHFFFAOYSA-N
Synonyms
312635-68-0
2(3nitro1H124triazol1yl)N(3nitro5(mtolyloxy)phenyl)acetamide
312635680
CC1=CC(=CC=C1)OC2=CC(=CC(=C2)(N+)(=O)(O))NC(=O)CN3C=NC(=N3)(N+)(=O)(O)
Cc1cccc(c1)Oc1cc(NC(=O)Cn2cnc(n2)(N+)(=O)(O))cc(c1)(N+)(=O)(O)
InChI=1SC17H14N6O6c11132414(511)2915712(613(815)22(25)26)1916(24)921101817(2021)23(27)28h2810H9H21H3(H1924)
MFCD01080888
N(3(3METHYLPHENOXY)5NITROPHENYL)2(3NITRO124TRIAZOL1YL)ACETAMIDE
N(3(3METHYLPHENOXY)5NITROPHENYL)2(3NITRO1H124TRIAZOL1YL)ACETAMIDE
N(3NITRO5MTOLYLOXYPHENYL)2(3NITRO(124)TRIAZOL1YL)ACETAMIDE
N(5(3METHYLPHENOXY)3NITROPHENYL)2(3NITRO(124TRIAZOLYL))ACETAMIDE
ZINC000002287951
ZINC02287951
ZINC2287951

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Available files

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