Vitas-M small molecule compound

2-(2-nitrophenyl)-1-[4-(pyrimidin-2-yl)piperazin-1-yl]ethanone

Catalog ID
STK465512
SMILES O=C(N1CCN(CC1)c1ncccn1)Cc1ccccc1[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 C16H17N5O3 MW 327.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17N5O3/c22-15(12-13-4-1-2-5-14(13)21(23)24)19-8-10-20(11-9-19)16-17-6-3-7-18-16/h1-7H,8-12H2
InChIKey
VFBWYBPECZFPNZ-UHFFFAOYSA-N
Synonyms

2(2nitrophenyl)1(4(pyrimidin2yl)piperazin1yl)ethanone
2(2NITROPHENYL)1(4PYRIMIDIN2YLPIPERAZIN1YL)ETHANONE
2(2NITROPHENYL)1(4PYRIMIDIN2YLPIPERAZINYL)ETHAN1ONE
C1CN(CCN1C2=NC=CC=N2)C(=O)CC3=CC=CC=C3(N+)(=O)(O)
InChI=1SC16H17N5O3c2215(1213412514(13)21(23)24)1981020(11919)16176371816h17H812H2
MFCD06624827
O=C(N1CCN(CC1)c1ncccn1)Cc1ccccc1(N+)(=O)(O)
ZINC000002872618
ZINC02872618
ZINC2872618

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Available files

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