2-[[2-[3-(1-adamantylcarbamoylamino)phenyl]-6-[4-(hydroxymethyl)phenyl]-5-methyl-1,3-dioxan-4-yl]methylsulfanyl]pyridine-3-carboxylic acid
Molecular Formula:
C36H41N3O6S
InChI: InChI=1/C36H41N3O6S/c1-21-30(20-46-32-29(33(41)42)6-3-11-37-32)44-34(45-31(21)26-9-7-22(19-40)8-10-26)27-4-2-5-28(15-27)38-35(43)39-36-16-23-12-24(17-36)14-25(13-23)18-36/h2-11,15,21,23-25,30-31,34,40H,12-14,16-20H2,1H3,(H,41,42)(H2,38,39,43)/f/h38-39,41H
InChIKey: InChIKey=SLHRUKHXXYVWCL-NSFAQDJFCO
SMILES: CC1C(OC(OC1C2=CC=C(C=C2)CO)C3=CC(=CC=C3)NC(=O)NC45CC6CC(C4)CC(C6)C5)CSC7=C(C=CC=N7)C(=O)O
Names:
2-[[2-[3-(1-adamantylcarbamoylamino)phenyl]-6-[4-(hydroxymethyl)phenyl]-5-methyl-1,3-dioxan-4-yl]methylsulfanyl]pyridine-3-carboxylic acid
Registries:
PubChem CID 4096907
PubChem ID 6017835
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