Vitas-M small molecule compound
[4-(3-methoxybenzyl)piperazin-1-yl](4-nitro-1H-pyrazol-3-yl)methanone
Catalog ID
STK307965
SMILES COc1cccc(c1)CN1CCN(CC1)C(=O)c1n[nH]cc1[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 C16H19N5O4 MW 345.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19N5O4/c1-25-13-4-2-3-12(9-13)11-19-5-7-20(8-6-19)16(22)15-14(21(23)24)10-17-18-15/h2-4,9-10H,5-8,11H2,1H3,(H,17,18)InChIKey
IWTYRXZLFJEIGR-UHFFFAOYSA-NSynonyms
1005593-43-0(4((3methoxyphenyl)methyl)piperazin1yl)(4nitro1Hpyrazol5yl)methanone
(4(3methoxybenzyl)piperazin1yl)(4nitro1Hpyrazol3yl)methanone
1005593430
COC1=CC=CC(=C1)CN2CCN(CC2)C(=O)C3=C(C=NN3)(N+)(=O)(O)
COc1cccc(c1)CN1CCN(CC1)C(=O)c1n(nH)cc1(N+)(=O)(O)
InChI=1SC16H19N5O4c1251342312(913)11195720(8619)16(22)1514(21(23)24)10171815h24910H5811H21H3(H1718)
MFCD04131483
ZINC000020028668
ZINC20028668
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