Vitas-M small molecule compound
1-[(3-{[4-(5-chloro-2-methylphenyl)piperazin-1-yl]sulfonyl}-1-ethyl-1H-pyrazol-4-yl)carbonyl]piperidin-4-one
Catalog ID
STL132942
SMILES CCn1cc(c(n1)S(=O)(=O)N1CCN(CC1)c1cc(Cl)ccc1C)C(=O)N1CCC(=O)CC1
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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 C22H28ClN5O4S MW 494.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28ClN5O4S/c1-3-27-15-19(22(30)26-8-6-18(29)7-9-26)21(24-27)33(31,32)28-12-10-25(11-13-28)20-14-17(23)5-4-16(20)2/h4-5,14-15H,3,6-13H2,1-2H3InChIKey
BMGJDMLMBRKKGC-UHFFFAOYSA-NSynonyms
1((3((4(5chloro2methylphenyl)piperazin1yl)sulfonyl)1ethyl1Hpyrazol4yl)carbonyl)piperidin4one
1(3(4(5chloro2methylphenyl)piperazin1yl)sulfonyl1ethylpyrazole4carbonyl)piperidin4one
CCN1C=C(C(=N1)S(=O)(=O)N2CCN(CC2)C3=C(C=CC(=C3)Cl)C)C(=O)N4CCC(=O)CC4
InChI=1SC22H28ClN5O4Sc13271519(22(30)268618(29)7926)21(2427)33(3132)28121025(111328)201417(23)5416(20)2h451415H3613H212H3
MFCD20752885
ZINC000067338047
ZINC67338047
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