Analyte Name

3aR,4R,7S,7aS-Tetrahydro Lurasidone Hydrochloride

Molecular Formula

C28 H34 N4 O2 S . H Cl

Molecular Weight

527.121

Accurate Mass

526.217

SMILES

Cl.O=C1[C@@H]2[C@@H]3C[C@@H](C=C3)[C@@H]2C(=O)N1C[C@@H]4CCCC[C@H]4CN5CCN(CC5)c6nsc7ccccc67

InChI

InChI=1S/C28H34N4O2S.ClH/c33-27-24-18-9-10-19(15-18)25(24)28(34)32(27)17-21-6-2-1-5-20(21)16-30-11-13-31(14-12-30)26-22-7-3-4-8-23(22)35-29-26;/h3-4,7-10,18-21,24-25H,1-2,5-6,11-17H2;1H/t18-,19+,20-,21-,24+,25-;/m0./s1

IUPAC

(1S,2S,6R,7R)-4-[[(1R,2R)-2-[[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]methyl]cyclohexyl]methyl]-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione;hydrochloride

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat