1-(1-adamantyl)-3-[[3-[4-[4-[4-(hydroxymethyl)phenyl]-6-[(2-methoxyphenyl)sulfanylmethyl]-5-methyl-1,3-dioxan-2-yl]phenyl]phenyl]methyl]urea
Molecular Formula:
C44H50N2O5S
InChI: InChI=1/C44H50N2O5S/c1-28-39(27-52-40-9-4-3-8-38(40)49-2)50-42(51-41(28)35-12-10-29(26-47)11-13-35)36-16-14-34(15-17-36)37-7-5-6-30(21-37)25-45-43(48)46-44-22-31-18-32(23-44)20-33(19-31)24-44/h3-17,21,28,31-33,39,41-42,47H,18-20,22-27H2,1-2H3,(H2,45,46,48)/f/h45-46H
InChIKey: InChIKey=JXYSFISOWOKLEI-XAIUAXLWCU
SMILES: CC1C(OC(OC1C2=CC=C(C=C2)CO)C3=CC=C(C=C3)C4=CC(=CC=C4)CNC(=O)NC56CC7CC(C5)CC(C7)C6)CSC8=CC=CC=C8OC
Names:
1-(1-adamantyl)-3-[[3-[4-[4-[4-(hydroxymethyl)phenyl]-6-[(2-methoxyphenyl)sulfanylmethyl]-5-methyl-1,3-dioxan-2-yl]phenyl]phenyl]methyl]urea
Registries:
PubChem CID 4098579
PubChem ID 6020065
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