3-[[3-[4-[4-[4-(hydroxymethyl)phenyl]-6-(2H-1,2,4-triazol-3-ylsulfanylmethyl)-1,3-dioxan-2-yl]phenyl]phenyl]methylcarbamoyl]propanoic acid
Molecular Formula:
C31H32N4O6S
InChI: InChI=1/C31H32N4O6S/c36-17-20-4-6-23(7-5-20)27-15-26(18-42-31-33-19-34-35-31)40-30(41-27)24-10-8-22(9-11-24)25-3-1-2-21(14-25)16-32-28(37)12-13-29(38)39/h1-11,14,19,26-27,30,36H,12-13,15-18H2,(H,32,37)(H,38,39)(H,33,34,35)/f/h32,35,38H
InChIKey: InChIKey=XWXLTNXFAPNMDW-DKLWOSEYCB
SMILES: C1C(OC(OC1C2=CC=C(C=C2)CO)C3=CC=C(C=C3)C4=CC(=CC=C4)CNC(=O)CCC(=O)O)CSC5=NC=NN5
Names:
3-[[3-[4-[4-[4-(hydroxymethyl)phenyl]-6-(2H-1,2,4-triazol-3-ylsulfanylmethyl)-1,3-dioxan-2-yl]phenyl]phenyl]methylcarbamoyl]propanoic acid
Registries:
PubChem CID 4088654
PubChem ID 6006980
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