Vitas-M small molecule compound

4-(5-methyl-3-nitro-1H-pyrazol-1-yl)-1-(4-phenylpiperazin-1-yl)butan-1-one

Catalog ID
STL036642
SMILES O=C(N1CCN(CC1)c1ccccc1)CCCn1nc(cc1C)[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 C18H23N5O3 MW 357.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23N5O3/c1-15-14-17(23(25)26)19-22(15)9-5-8-18(24)21-12-10-20(11-13-21)16-6-3-2-4-7-16/h2-4,6-7,14H,5,8-13H2,1H3
InChIKey
BLSOXEDSWXUHLC-UHFFFAOYSA-N
Synonyms
897543-80-5
4(5methyl3nitro1Hpyrazol1yl)1(4phenylpiperazin1yl)butan1one
4(5METHYL3NITROPYRAZOL1YL)1(4PHENYLPIPERAZIN1YL)BUTAN1ONE
897543805
CC1=CC(=NN1CCCC(=O)N2CCN(CC2)C3=CC=CC=C3)(N+)(=O)(O)
InChI=1SC18H23N5O3c1151417(23(25)26)1922(15)95818(24)21121020(111321)166324716h246714H5813H21H3
MFCD06164468
O=C(N1CCN(CC1)c1ccccc1)CCCn1nc(cc1C)(N+)(=O)(O)
ZINC000002440238
ZINC02440238
ZINC2440238

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Available files

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