Vitas-M small molecule compound
(3-{[4-(5-chloro-2-methylphenyl)piperazin-1-yl]sulfonyl}-1-methyl-1H-pyrazol-4-yl)(piperidin-1-yl)methanone
Catalog ID
STL132895
SMILES O=C(c1cn(nc1S(=O)(=O)N1CCN(CC1)c1cc(Cl)ccc1C)C)N1CCCCC1
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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/c1-16-6-7-17(22)14-19(16)25-10-12-27(13-11-25)31(29,30)20-18(15-24(2)23-20)21(28)26-8-4-3-5-9-26/h6-7,14-15H,3-5,8-13H2,1-2H3InChIKey
XIPPFZTWJSHCOP-UHFFFAOYSA-NSynonyms
(3((4(5chloro2methylphenyl)piperazin1yl)sulfonyl)1methyl1Hpyrazol4yl)(piperidin1yl)methanone
(3(4(5chloro2methylphenyl)piperazin1yl)sulfonyl1methylpyrazol4yl)piperidin1ylmethanone
CC1=C(C=C(C=C1)Cl)N2CCN(CC2)S(=O)(=O)C3=NN(C=C3C(=O)N4CCCCC4)C
InChI=1SC21H28ClN5O3Sc1166717(22)1419(16)25101227(131125)31(2930)2018(1524(2)2320)21(28)268435926h671415H35813H212H3
MFCD20752838
ZINC000067337910
ZINC67337910
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