Products 186204-37-5

CAS 186204-37-5 appears in our catalog under these names: Lurasidone Impurity 34, (3aR,7aR)-4'-(1,2-Benzisothiazol-3-yl)octahydro-spiro(2H-isoindole-2,1'-piperazinium) Methanesulfonate, >95% (HPLC), (3aR,7aR)-4'-(1,2-Benzisothiazol-3-yl) octahydro-spiro(2H-isoindole-2,1'-piperazinium) methanesulfonate, (3aR,7aR)-4'-(Benzo[d]isothiazol-3-yl)octahydrospiro[isoindole-2,1'-piperazin]-2-ium methanesulfonate 98%, (3AR,7AR)-4'-(BENZO[D]ISOTHIAZOL-3-YL)OCTAHYDROSPIRO[ISOINDOLE-2,1'-PIPERAZIN]-1'-IUM METHANESULFONATE, 98%, 98%. Offered by: Chemat Brand, TRC, Biosynth, Ambeed, Chemat. Available pack sizes: on request, 50mg, 250g, 100g, 1g, 5g, 25g, 10g.

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

3-[(3aR,7aR)-spiro[1,3,3a,4,5,6,7,7a-octahydroisoindol-2-ium-2,4'-1,4-diazinan-4-ium]-1'-yl]-1,2-benzothiazole;methanesulfonate (CAS 186204-37-5) is a chemical compound with the molecular formula C20H29N3O3S2 and a molecular weight of 423.6 g/mol. IUPAC name: 3-[(3aR,7aR)-spiro[1,3,3a,4,5,6,7,7a-octahydroisoindol-2-ium-2,4'-1,4-diazinan-4-ium]-1'-yl]-1,2-benzothiazole;methanesulfonate. InChIKey: DCZWVXNDLGWVAS-MOGJOVFKSA-M.

Identity
Molecular formulaC20H29N3O3S2
Molecular weight423.6 g/mol
IUPAC name3-[(3aR,7aR)-spiro[1,3,3a,4,5,6,7,7a-octahydroisoindol-2-ium-2,4'-1,4-diazinan-4-ium]-1'-yl]-1,2-benzothiazole;methanesulfonate
InChIKeyDCZWVXNDLGWVAS-MOGJOVFKSA-M
SMILESCS(=O)(=O)[O-].C1CC[C@H]2C[N+]3(CCN(CC3)C4=NSC5=CC=CC=C54)C[C@@H]2C1

Computed by PubChem (NCBI)