Products 139563-18-1

CAS 139563-18-1 appears in our catalog under these names: Lurasidone Impurity 5, ent-Lurasidone Hydrochloride. Offered by: Hubei YoungXin, TRC. Available pack sizes: 10mg, 25mg, 50mg, 100mg, 200mg.

Structural formula: {0} (CAS {1})

(1S,2R,6S,7R)-4-[[(1S,2S)-2-[[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]methyl]cyclohexyl]methyl]-4-azatricyclo[5.2.1.02,6]decane-3,5-dione;hydrochloride (CAS 139563-18-1) is a chemical compound with the molecular formula C28H37ClN4O2S and a molecular weight of 529.1 g/mol. IUPAC name: (1S,2R,6S,7R)-4-[[(1S,2S)-2-[[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]methyl]cyclohexyl]methyl]-4-azatricyclo[5.2.1.02,6]decane-3,5-dione;hydrochloride. InChIKey: NEKCRUIRPWNMLK-MBTNCXEKSA-N.

Identity
Molecular formulaC28H37ClN4O2S
Molecular weight529.1 g/mol
IUPAC name(1S,2R,6S,7R)-4-[[(1S,2S)-2-[[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]methyl]cyclohexyl]methyl]-4-azatricyclo[5.2.1.02,6]decane-3,5-dione;hydrochloride
InChIKeyNEKCRUIRPWNMLK-MBTNCXEKSA-N
SMILESC1CC[C@@H]([C@H](C1)CN2CCN(CC2)C3=NSC4=CC=CC=C43)CN5C(=O)[C@H]6[C@@H]7CC[C@@H](C7)[C@H]6C5=O.Cl

Computed by PubChem (NCBI)