Vitas-M small molecule compound

1-[3-(3,5-dimethyl-1H-pyrazol-1-yl)-4-nitrophenyl]-4-[(4-methylphenyl)sulfonyl]piperazine

Catalog ID
STK065478
SMILES Cc1ccc(cc1)S(=O)(=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 C22H25N5O4S MW 455.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N5O4S/c1-16-4-7-20(8-5-16)32(30,31)25-12-10-24(11-13-25)19-6-9-21(27(28)29)22(15-19)26-18(3)14-17(2)23-26/h4-9,14-15H,10-13H2,1-3H3
InChIKey
JAEOYBIVTRDLDJ-UHFFFAOYSA-N
Synonyms

1(3(35DIMETHYL1HPYRAZOL1YL)4NITROPHENYL)4((4METHYLPHENYL)SULFONYL)PIPERAZINE
1(3(35dimethyl1Hpyrazol1yl)4nitrophenyl)4tosylpiperazine
1(3(35DIMETHYLPYRAZOL1YL)4NITROPHENYL)4(4METHYLPHENYL)SULFONYLPIPERAZINE
4(3(35DIMETHYLPYRAZOLYL)4NITROPHENYL)1((4METHYLPHENYL)SULFONYL)PIPERAZINE
CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=CC(=C(C=C3)(N+)(=O)(O))N4C(=CC(=N4)C)C
Cc1ccc(cc1)S(=O)(=O)N1CCN(CC1)c1ccc(c(c1)n1nc(cc1C)C)(N+)(=O)(O)
InChI=1SC22H25N5O4Sc1164720(8516)32(3031)25121024(111325)196921(27(28)29)22(1519)2618(3)1417(2)2326h491415H1013H213H3
MFCD02627875
STK065478
ZINC000008385730
ZINC08385730
ZINC8385730

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Available files

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