2-[[6-[4-(hydroxymethyl)phenyl]-2-[4-[3-[[[1-(2,2,2-trifluoroacetyl)pyrrolidine-2-carbonyl]amino]methyl]phenyl]phenyl]-1,3-dioxan-4-yl]methylsulfanyl]pyridine-3-carboxylic acid
Molecular Formula:
C38H36F3N3O7S
InChI: InChI=1/C38H36F3N3O7S/c39-38(40,41)37(49)44-17-3-7-31(44)33(46)43-20-24-4-1-5-28(18-24)25-12-14-27(15-13-25)36-50-29(22-52-34-30(35(47)48)6-2-16-42-34)19-32(51-36)26-10-8-23(21-45)9-11-26/h1-2,4-6,8-16,18,29,31-32,36,45H,3,7,17,19-22H2,(H,43,46)(H,47,48)/f/h43,47H
InChIKey: InChIKey=WTXUMXNSRSOFBQ-GOANIHMKCU
SMILES: C1CC(N(C1)C(=O)C(F)(F)F)C(=O)NCC2=CC=CC(=C2)C3=CC=C(C=C3)C4OC(CC(O4)C5=CC=C(C=C5)CO)CSC6=C(C=CC=N6)C(=O)O
Names:
2-[[6-[4-(hydroxymethyl)phenyl]-2-[4-[3-[[[1-(2,2,2-trifluoroacetyl)pyrrolidine-2-carbonyl]amino]methyl]phenyl]phenyl]-1,3-dioxan-4-yl]methylsulfanyl]pyridine-3-carboxylic acid
Registries:
PubChem CID 4120315
PubChem ID 6049343
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