4-[[2-[3-(ethylcarbamoylamino)phenyl]-6-[4-(hydroxymethyl)phenyl]-5-methyl-1,3-dioxan-4-yl]methylsulfanyl]benzoic acid
Molecular Formula:
C29H32N2O6S
InChI: InChI=1/C29H32N2O6S/c1-3-30-29(35)31-23-6-4-5-22(15-23)28-36-25(17-38-24-13-11-21(12-14-24)27(33)34)18(2)26(37-28)20-9-7-19(16-32)8-10-20/h4-15,18,25-26,28,32H,3,16-17H2,1-2H3,(H,33,34)(H2,30,31,35)/f/h30-31,33H
InChIKey: InChIKey=IQGHSWGKMKZZDF-PWXUCDMJCC
SMILES: CCNC(=O)NC1=CC=CC(=C1)C2OC(C(C(O2)C3=CC=C(C=C3)CO)C)CSC4=CC=C(C=C4)C(=O)O
Names:
4-[[2-[3-(ethylcarbamoylamino)phenyl]-6-[4-(hydroxymethyl)phenyl]-5-methyl-1,3-dioxan-4-yl]methylsulfanyl]benzoic acid
Registries:
PubChem CID 4120100
PubChem ID 6049053
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