N'-(2-aminophenyl)-N-[[2-[4-[4-(benzothiazol-2-ylsulfanylmethyl)-6-[4-(hydroxymethyl)phenyl]-1,3-dioxan-2-yl]phenyl]phenyl]methyl]heptanediamide

Molecular Formula: C45H46N4O5S2


InChI: InChI=1/C45H46N4O5S2/c46-37-12-6-7-13-38(37)48-43(52)17-3-1-2-16-42(51)47-27-34-10-4-5-11-36(34)31-22-24-33(25-23-31)44-53-35(26-40(54-44)32-20-18-30(28-50)19-21-32)29-55-45-49-39-14-8-9-15-41(39)56-45/h4-15,18-25,35,40,44,50H,1-3,16-17,26-29,46H2,(H,47,51)(H,48,52)/f/h47-48H

InChIKey: InChIKey=MHWKDGQUTOYPNB-WFSYQJDGCY
SMILES: C1C(OC(OC1C2=CC=C(C=C2)CO)C3=CC=C(C=C3)C4=CC=CC=C4CNC(=O)CCCCCC(=O)NC5=CC=CC=C5N)CSC6=NC7=CC=CC=C7S6

Names:
    N'-(2-aminophenyl)-N-[[2-[4-[4-(benzothiazol-2-ylsulfanylmethyl)-6-[4-(hydroxymethyl)phenyl]-1,3-dioxan-2-yl]phenyl]phenyl]methyl]heptanediamide

Registries:
    PubChem CID 4456712
    PubChem ID 6569727