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

InChIKey: InChIKey=HCLHBTDEFSXNQQ-WFSYQJDGCD
SMILES: C1C(OC(OC1C2=CC=C(C=C2)CO)C3=CC=C(C=C3)C4=CC(=CC=C4)CNC(=O)CCCCCC(=O)NC5=CC=CC=C5N)CSC6=NC7=CC=CC=C7S6

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

Registries:
    PubChem CID 3541333
    PubChem ID 4783695