Vitas-M small molecule compound

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

Catalog ID
STK157825
SMILES CCc1ccc(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 C24H27N5O3 MW 433.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27N5O3/c1-4-19-5-7-20(8-6-19)24(30)27-13-11-26(12-14-27)21-9-10-22(29(31)32)23(16-21)28-18(3)15-17(2)25-28/h5-10,15-16H,4,11-14H2,1-3H3
InChIKey
JLTDYQRSMBLLFR-UHFFFAOYSA-N
Synonyms
591736-99-1
(4(3(35DIMETHYL1HPYRAZOL1YL)4NITROPHENYL)PIPERAZIN1YL)(4ETHYLPHENYL)METHANONE
(4(3(35DIMETHYLPYRAZOL1YL)4NITROPHENYL)PIPERAZIN1YL)(4ETHYLPHENYL)METHANONE
591736991
CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC(=C(C=C3)(N+)(=O)(O))N4C(=CC(=N4)C)C
CCc1ccc(cc1)C(=O)N1CCN(CC1)c1ccc(c(c1)n1nc(cc1C)C)(N+)(=O)(O)
InChI=1SC24H27N5O3c14195720(8619)24(30)27131126(121427)2191022(29(31)32)23(1621)2818(3)1517(2)2528h5101516H41114H213H3
MFCD03691605
ZINC000004199578
ZINC04199578
ZINC4199578

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.