Vitas-M small molecule compound
azepan-1-yl(3-{[4-(2-chlorophenyl)piperazin-1-yl]sulfonyl}-1-methyl-1H-pyrazol-4-yl)methanone
Catalog ID
STL132636
SMILES Cn1cc(c(n1)S(=O)(=O)N1CCN(CC1)c1ccccc1Cl)C(=O)N1CCCCCC1
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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 C21H28ClN5O3S MW 466.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28ClN5O3S/c1-24-16-17(21(28)26-10-6-2-3-7-11-26)20(23-24)31(29,30)27-14-12-25(13-15-27)19-9-5-4-8-18(19)22/h4-5,8-9,16H,2-3,6-7,10-15H2,1H3InChIKey
PLMOYPWRQBIRLI-UHFFFAOYSA-NSynonyms
azepan1yl(3((4(2chlorophenyl)piperazin1yl)sulfonyl)1methyl1Hpyrazol4yl)methanone
azepan1yl(3(4(2chlorophenyl)piperazin1yl)sulfonyl1methylpyrazol4yl)methanone
CN1C=C(C(=N1)S(=O)(=O)N2CCN(CC2)C3=CC=CC=C3Cl)C(=O)N4CCCCCC4
InChI=1SC21H28ClN5O3Sc1241617(21(28)261062371126)20(2324)31(2930)27141225(131527)19954818(19)22h458916H23671015H21H3
MFCD20752578
ZINC000067337159
ZINC67337159
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