1-[[4-[4-[4-(hydroxymethyl)phenyl]-5-phenyl-6-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-1,3-dioxan-2-yl]phenyl]methyl]-3-(3-oxo-1-phenyl-butan-2-yl)urea
Molecular Formula:
C
44
H
48
N
6
O
5
InChI:
InChI=1/C44H48N6O5/c1-31(52)38(27-32-9-4-2-5-10-32)48-44(53)47-28-33-13-19-37(20-14-33)42-54-39(29-49-23-25-50(26-24-49)43-45-21-8-22-46-43)40(35-11-6-3-7-12-35)41(55-42)36-17-15-34(30-51)16-18-36/h2-22,38-42,51H,23-30H2,1H3,(H2,47,48,53)/f/h47-48H
InChIKey:
InChIKey=ILDUAEFJRRAJNA-WFSYQJDGCS
SMILES:
CC(=O)C(CC1=CC=CC=C1)NC(=O)NCC2=CC=C(C=C2)C3OC(C(C(O3)C4=CC=C(C=C4)CO)C5=CC=CC=C5)CN6CCN(CC6)C7=NC=CC=N7
Names:
1-[[4-[4-[4-(hydroxymethyl)phenyl]-5-phenyl-6-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-1,3-dioxan-2-yl]phenyl]methyl]-3-(3-oxo-1-phenyl-butan-2-yl)urea
Registries:
PubChem CID 4128314
PubChem ID 6060074
