Chemical

CAS: 186204-31-9(Unlabeled)

(3aR,4S,5R,7S,7aS)-2-(((1R,2R)-2-((4-(benzo[d]isothiazol-3-yl)piperazin-1-yl-2,2,3,3,5,5,6,6-d8)methyl)cyclohexyl)methyl)-5-hydroxyhexahydro-1H-4,7-methanoisoindole-1,3(2H)-dione

Lurasidone Metabolite 14283-d8

Formula: C₂₈H₂₈D₈N₄O₃S

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Key details (from tblproducts)

CAS	186204-31-9(Unlabeled)
Category	Metabolite
Molecular formula	C₂₈H₂₈D₈N₄O₃S
Molecular weight	516.73
IUPAC	(3aR,4S,5R,7S,7aS)-2-(((1R,2R)-2-((4-(benzo[d]isothiazol-3-yl)piperazin-1-yl-2,2,3,3,5,5,6,6-d8)methyl)cyclohexyl)methyl)-5-hydroxyhexahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Smileys	O=C1N(C[C@H]2[C@H](CN3C([2H])([2H])C([2H])([2H])N(C4=NSC5=CC=CC=C45)C([2H])([2H])C3([2H])[2H])CCCC2)C([C@]6([H])[C@@](C7)([H])[C@H](O)C[C@@]7([H])[C@]16[H])=O

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