Vitas-M small molecule compound

furan-2-yl{4-[3-(methylamino)-4-nitrophenyl]piperazin-1-yl}methanone

Catalog ID
STK158029
SMILES CNc1cc(ccc1[N+](=O)[O-])N1CCN(CC1)C(=O)c1ccco1

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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 C16H18N4O4 MW 330.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N4O4/c1-17-13-11-12(4-5-14(13)20(22)23)18-6-8-19(9-7-18)16(21)15-3-2-10-24-15/h2-5,10-11,17H,6-9H2,1H3
InChIKey
IUAFTAXFPLFVRQ-UHFFFAOYSA-N
Synonyms
591726-86-2
591726862
CNC1=C(C=CC(=C1)N2CCN(CC2)C(=O)C3=CC=CO3)(N+)(=O)(O)
CNc1cc(ccc1(N+)(=O)(O))N1CCN(CC1)C(=O)c1ccco1
FURAN2YL(4(3(METHYLAMINO)4NITROPHENYL)PIPERAZIN1YL)METHANONE
InChI=1SC16H18N4O4c117131112(4514(13)20(22)23)186819(9718)16(21)1532102415h25101117H69H21H3
MFCD03687059
ZINC000004688282
ZINC04688282
ZINC4688282

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Available files

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