1-(1-adamantyl)-3-[[2-[4-[4-[4-(hydroxymethyl)phenyl]-5-methyl-6-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3-dioxan-2-yl]phenyl]phenyl]methyl]urea
Molecular Formula:
C40H47N5O4S
InChI: InChI=1/C40H47N5O4S/c1-25-35(23-50-39-44-42-24-45(39)2)48-37(49-36(25)31-9-7-26(22-46)8-10-31)32-13-11-30(12-14-32)34-6-4-3-5-33(34)21-41-38(47)43-40-18-27-15-28(19-40)17-29(16-27)20-40/h3-14,24-25,27-29,35-37,46H,15-23H2,1-2H3,(H2,41,43,47)/f/h41,43H
InChIKey: InChIKey=VEIKSVIBMJRHEN-BLHHPTNJCA
SMILES: CC1C(OC(OC1C2=CC=C(C=C2)CO)C3=CC=C(C=C3)C4=CC=CC=C4CNC(=O)NC56CC7CC(C5)CC(C7)C6)CSC8=NN=CN8C
Names:
1-(1-adamantyl)-3-[[2-[4-[4-[4-(hydroxymethyl)phenyl]-5-methyl-6-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3-dioxan-2-yl]phenyl]phenyl]methyl]urea
Registries:
PubChem CID 4115801
PubChem ID 6043283
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