Vitas-M small molecule compound

{4-[3-(3,5-dimethyl-1H-pyrazol-1-yl)-4-nitrophenyl]piperazin-1-yl}(4-propoxyphenyl)methanone

Catalog ID
STK205936
SMILES CCCOc1ccc(cc1)C(=O)N1CCN(CC1)c1ccc(c(c1)n1nc(cc1C)C)[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 C25H29N5O4 MW 463.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29N5O4/c1-4-15-34-22-8-5-20(6-9-22)25(31)28-13-11-27(12-14-28)21-7-10-23(30(32)33)24(17-21)29-19(3)16-18(2)26-29/h5-10,16-17H,4,11-15H2,1-3H3
InChIKey
BWNJMMPNOBZBMA-UHFFFAOYSA-N
Synonyms

(4(3(35DIMETHYL1HPYRAZOL1YL)4NITROPHENYL)PIPERAZIN1YL)(4PROPOXYPHENYL)METHANONE
(4(3(35DIMETHYLPYRAZOL1YL)4NITROPHENYL)PIPERAZIN1YL)(4PROPOXYPHENYL)METHANONE
CCCOC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC(=C(C=C3)(N+)(=O)(O))N4C(=CC(=N4)C)C
CCCOc1ccc(cc1)C(=O)N1CCN(CC1)c1ccc(c(c1)n1nc(cc1C)C)(N+)(=O)(O)
InChI=1SC25H29N5O4c141534228520(6922)25(31)28131127(121428)2171023(30(32)33)24(1721)2919(3)1618(2)2629h5101617H41115H213H3
MFCD06005492
ZINC000009971711
ZINC09971711
ZINC9971711

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Available files

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