Vitas-M small molecule compound
(3-{[4-(5-chloro-2-methylphenyl)piperazin-1-yl]sulfonyl}-1-methyl-1H-pyrazol-4-yl)(1,4-dioxa-8-azaspiro[4.5]dec-8-yl)methanone
Catalog ID
STL132899
SMILES O=C(c1cn(nc1S(=O)(=O)N1CCN(CC1)c1cc(Cl)ccc1C)C)N1CCC2(CC1)OCCO2
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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 C23H30ClN5O5S MW 524.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H30ClN5O5S/c1-17-3-4-18(24)15-20(17)27-9-11-29(12-10-27)35(31,32)21-19(16-26(2)25-21)22(30)28-7-5-23(6-8-28)33-13-14-34-23/h3-4,15-16H,5-14H2,1-2H3InChIKey
FUGHQRYJZHGWHN-UHFFFAOYSA-NSynonyms
(3((4(5chloro2methylphenyl)piperazin1yl)sulfonyl)1methyl1Hpyrazol4yl)(14dioxa8azaspiro(45)dec8yl)methanone
(3(4(5chloro2methylphenyl)piperazin1yl)sulfonyl1methylpyrazol4yl)(14dioxa8azaspiro(45)decan8yl)methanone
CC1=C(C=C(C=C1)Cl)N2CCN(CC2)S(=O)(=O)C3=NN(C=C3C(=O)N4CCC5(CC4)OCCO5)C
InChI=1SC23H30ClN5O5Sc1173418(24)1520(17)2791129(121027)35(3132)2119(1626(2)2521)22(30)287523(6828)3313143423h341516H514H212H3
MFCD20752842
ZINC000067337927
ZINC67337927
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