Vitas-M small molecule compound

1-(4-benzylpiperidin-1-yl)-3-(3-nitro-1H-pyrazol-1-yl)propan-1-one

Catalog ID
STK302539
SMILES O=C(N1CCC(CC1)Cc1ccccc1)CCn1ccc(n1)[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 C18H22N4O3 MW 342.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N4O3/c23-18(9-13-21-12-8-17(19-21)22(24)25)20-10-6-16(7-11-20)14-15-4-2-1-3-5-15/h1-5,8,12,16H,6-7,9-11,13-14H2
InChIKey
LSFVVWUNUSROCY-UHFFFAOYSA-N
Synonyms
957489-56-4
1(4benzylpiperidin1yl)3(3nitro1Hpyrazol1yl)propan1one
1(4BENZYLPIPERIDIN1YL)3(3NITROPYRAZOL1YL)PROPAN1ONE
3(3NITROPYRAZOLYL)1(4BENZYLPIPERIDYL)PROPAN1ONE
4BENZYL1(3(3NITRO1HPYRAZOL1YL)PROPANOYL)PIPERIDINE
957489564
C1CN(CCC1CC2=CC=CC=C2)C(=O)CCN3C=CC(=N3)(N+)(=O)(O)
InChI=1SC18H22N4O3c2318(9132112817(1921)22(24)25)2010616(71120)14154213515h1581216H679111314H2
MFCD04048147
O=C(N1CCC(CC1)Cc1ccccc1)CCn1ccc(n1)(N+)(=O)(O)
ZINC000002739356
ZINC02739356
ZINC2739356

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Available files

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