4-[[2-[4-[(1-adamantylcarbamoylamino)methyl]phenyl]-6-[4-(hydroxymethyl)phenyl]-1,3-dioxan-4-yl]methylsulfanyl]benzoic acid

Molecular Formula: C₃₇H₄₂N₂O₆S

InChI: InChI=1/C37H42N2O6S/c40-21-24-3-5-28(6-4-24)33-16-31(22-46-32-11-9-29(10-12-32)34(41)42)44-35(45-33)30-7-1-23(2-8-30)20-38-36(43)39-37-17-25-13-26(18-37)15-27(14-25)19-37/h1-12,25-27,31,33,35,40H,13-22H2,(H,41,42)(H2,38,39,43)/f/h38-39,41H

InChIKey: InChIKey=MZSHSRAWFDNFNQ-NSFAQDJFCK
SMILES: C1C2CC3CC1CC(C2)(C3)NC(=O)NCC4=CC=C(C=C4)C5OC(CC(O5)C6=CC=C(C=C6)CO)CSC7=CC=C(C=C7)C(=O)O

Names:
4-[[2-[4-[(1-adamantylcarbamoylamino)methyl]phenyl]-6-[4-(hydroxymethyl)phenyl]-1,3-dioxan-4-yl]methylsulfanyl]benzoic acid

Registries:
PubChem CID 4108154
PubChem ID 6032903