Vitas-M small molecule compound

1-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-4-[3-(3,5-dimethyl-1H-pyrazol-1-yl)-4-nitrophenyl]piperazine

Catalog ID
STK271467
SMILES COc1cc(ccc1OC)c1csc(n1)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 C26H28N6O4S MW 520.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N6O4S/c1-17-13-18(2)31(28-17)23-15-20(6-7-22(23)32(33)34)29-9-11-30(12-10-29)26-27-21(16-37-26)19-5-8-24(35-3)25(14-19)36-4/h5-8,13-16H,9-12H2,1-4H3
InChIKey
QQLMYNUPWFJVPL-UHFFFAOYSA-N
Synonyms

1(4(34dimethoxyphenyl)13thiazol2yl)4(3(35dimethyl1Hpyrazol1yl)4nitrophenyl)piperazine
4(2(4(3(35DIMETHYLPYRAZOLYL)4NITROPHENYL)PIPERAZINYL)(13THIAZOL4YL))12DIMETHOXYBENZENE
4(34DIMETHOXYPHENYL)2(4(3(35DIMETHYLPYRAZOL1YL)4NITROPHENYL)PIPERAZIN1YL)13THIAZOLE
CC1=CC(=NN1C2=C(C=CC(=C2)N3CCN(CC3)C4=NC(=CS4)C5=CC(=C(C=C5)OC)OC)(N+)(=O)(O))C
COc1cc(ccc1OC)c1csc(n1)N1CCN(CC1)c1ccc(c(c1)n1nc(cc1C)C)(N+)(=O)(O)
InChI=1SC26H28N6O4Sc1171318(2)31(2817)231520(6722(23)32(33)34)2991130(121029)262721(163726)195824(353)25(1419)364h581316H912H214H3
MFCD03856279
ZINC000008815922
ZINC08815922
ZINC8815922

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Available files

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