Molecular Formula: C28H29Cl2N3OS;

Related CAS #:2095432-58-7 (HCl) 912545-86-9 (free base)

Synonym: SAG hydrochloride; SAG; Smo agonist;

Chemical Name:3-chloro-N-((1r,4r)-4-(methylamino)cyclohexyl)-N-(3-(pyridin-4-yl)benzyl)benzo[b]thiophene-2-carboxamide hydrochloride

InChi Key:CRWTYWYPPITOOZ-HFSDZXIBSA-N

InChi Code:InChI=1S/C28H28ClN3OS.ClH/c1-30-22-9-11-23(12-10-22)32(28(33)27-26(29)24-7-2-3-8-25(24)34-27)18-19-5-4-6-21(17-19)20-13-15-31-16-14-20;/h2-8,13-17,22-23,30H,9-12,18H2,1H3;1H/t22-,23-;

SMILES Code:O=C(C1=C(Cl)C2=CC=CC=C2S1)N([C@H]3CC[C@H](NC)CC3)CC4=CC=CC(C5=CC=NC=C5)=C4.[H]Cl