Nombre del analito

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

Fórmula molecular

C28H34N4O2S • HCl

Peso molecular

527.13

Masa exacta

526.22

SMILES

O=C1N(C([C@@]2([C@@]3(C=C[C@]([H])([C@@]21[H])C3)[H])[H])=O)C[C@@H]4CCCC[C@@H]4CN5CCN(CC5)C6=NSC7=C6C=CC=C7.Cl

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+;/m1./s1

IUPAC

(3aR,4S,7R,7aS)-2-(((1R,2S)-2-((4-(benzo[d]isothiazol-3-yl)piperazin-1-yl)methyl)cyclohexyl)methyl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione hydrochloride

Alternar número CAS

Free Base: 139506-03-9

Temperatura de envío

Room Temperature

País de origen

CANADA

Formato del producto

Neat