Vitas-M small molecule compound

(4-butylpiperazin-1-yl)(3-{[4-(2-ethoxyphenyl)piperazin-1-yl]sulfonyl}-1-ethyl-1H-pyrazol-4-yl)methanone

Catalog ID
STL132582
SMILES CCCCN1CCN(CC1)C(=O)c1cn(nc1S(=O)(=O)N1CCN(CC1)c1ccccc1OCC)CC

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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 C26H40N6O4S MW 532.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H40N6O4S/c1-4-7-12-28-13-15-30(16-14-28)26(33)22-21-31(5-2)27-25(22)37(34,35)32-19-17-29(18-20-32)23-10-8-9-11-24(23)36-6-3/h8-11,21H,4-7,12-20H2,1-3H3
InChIKey
GJWROAVMMUAQJL-UHFFFAOYSA-N
Synonyms

(4butylpiperazin1yl)(3((4(2ethoxyphenyl)piperazin1yl)sulfonyl)1ethyl1Hpyrazol4yl)methanone
(4butylpiperazin1yl)(3(4(2ethoxyphenyl)piperazin1yl)sulfonyl1ethylpyrazol4yl)methanone
CCCCN1CCN(CC1)C(=O)C2=CN(N=C2S(=O)(=O)N3CCN(CC3)C4=CC=CC=C4OCC)CC
InChI=1SC26H40N6O4Sc1471228131530(161428)26(33)222131(52)2725(22)37(3435)32191729(182032)2310891124(23)3663h81121H471220H213H3
MFCD20752524
ZINC000067337002
ZINC67337002

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Available files

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