1-[4-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]-1,4-diazepan-1-yl]-2-[3-(trifluoromethylsulfanyl)phenyl]ethanone

Systemtic Name: 1-[4-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]-1,4-diazepan-1-yl]-2-[3-(trifluoromethylsulfanyl)phenyl]ethanone Openeye Name: 1-[4-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]-1,4-diazepan-1-yl]-2-[3-(trifluoromethylsulfanyl)phenyl]ethanone CAS Name: 1-[4-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]-1,4-diazepan-1-yl]-2-[3-(trifluoromethylthio)phenyl]ethanone IUPAC Name: 1-[4-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]-1,4-diazepan-1-yl]-2-[3-(trifluoromethylsulfanyl)phenyl]ethanone Traditional Name: 1-[4-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]-1,4-diazepan-1-yl]-2-[3-(trifluoromethylthio)phenyl]ethanone Formula: C23H23F3N4O2S MolecularWeight: 476.51453

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)CC2=CC(=CC=C2)SC(F)(F)F)CC3=NOC(=N3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN(C1)C(=O)CC2=CC(=CC=C2)SC(F)(F)F)CC3=NOC(=N3)C4=CC=CC=C4

InChI

InChI=1S/C23H23F3N4O2S/c24-23(25,26)33-19-9-4-6-17(14-19)15-21(31)30-11-5-10-29(12-13-30)16-20-27-22(32-28-20)18-7-2-1-3-8-18/h1-4,6-9,14H,5,10-13,15-16H2