1-(1-adamantyl)-3-[[3-[4-[4-[4-(hydroxymethyl)phenyl]-5-methyl-6-(2H-1,2,4-triazol-3-ylsulfanylmethyl)-1,3-dioxan-2-yl]phenyl]phenyl]methyl]urea
Molecular Formula:
C39H45N5O4S
InChI: InChI=1/C39H45N5O4S/c1-24-34(22-49-38-41-23-42-44-38)47-36(48-35(24)31-7-5-25(21-45)6-8-31)32-11-9-30(10-12-32)33-4-2-3-26(16-33)20-40-37(46)43-39-17-27-13-28(18-39)15-29(14-27)19-39/h2-12,16,23-24,27-29,34-36,45H,13-15,17-22H2,1H3,(H2,40,43,46)(H,41,42,44)/f/h40,43-44H
InChIKey: InChIKey=LKPLXKUNIVQCMK-OCMSKNHRCO
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=NC=NN8
Names:
1-(1-adamantyl)-3-[[3-[4-[4-[4-(hydroxymethyl)phenyl]-5-methyl-6-(2H-1,2,4-triazol-3-ylsulfanylmethyl)-1,3-dioxan-2-yl]phenyl]phenyl]methyl]urea
Registries:
PubChem CID 4102737
PubChem ID 6025629
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