Vitas-M small molecule compound

ethyl 1-[(3-{[4-(2,3-dimethylphenyl)piperazin-1-yl]sulfonyl}-1-ethyl-1H-pyrazol-4-yl)carbonyl]piperidine-3-carboxylate

Catalog ID
STL133062
SMILES CCOC(=O)C1CCCN(C1)C(=O)c1cn(nc1S(=O)(=O)N1CCN(CC1)c1cccc(c1C)C)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 C26H37N5O5S MW 531.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H37N5O5S/c1-5-30-18-22(25(32)29-12-8-10-21(17-29)26(33)36-6-2)24(27-30)37(34,35)31-15-13-28(14-16-31)23-11-7-9-19(3)20(23)4/h7,9,11,18,21H,5-6,8,10,12-17H2,1-4H3
InChIKey
KDCJFVNQMJKIFS-UHFFFAOYSA-N
Synonyms

CCN1C=C(C(=N1)S(=O)(=O)N2CCN(CC2)C3=CC=CC(=C3C)C)C(=O)N4CCCC(C4)C(=O)OCC
ethyl1((3((4(23dimethylphenyl)piperazin1yl)sulfonyl)1ethyl1Hpyrazol4yl)carbonyl)piperidine3carboxylate
ethyl1(3(4(23dimethylphenyl)piperazin1yl)sulfonyl1ethylpyrazole4carbonyl)piperidine3carboxylate
InChI=1SC26H37N5O5Sc15301822(25(32)291281021(1729)26(33)3662)24(2730)37(3435)31151328(141631)23117919(3)20(23)4h79111821H568101217H214H3
MFCD20753005
ZINC000067338350
ZINC000067338354

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Available files

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