4-[4-[[[2-[2,4-bis(fluoranyl)phenyl]-2-oxidanyl-3-(1,2,4-triazol-1-yl)propyl]-methyl-amino]methyl]phenyl]-2-[(2-chlorophenyl)methyl]-1,2,4-triazol-3-one

Systemtic Name: 4-[4-[[[2-[2,4-bis(fluoranyl)phenyl]-2-oxidanyl-3-(1,2,4-triazol-1-yl)propyl]-methyl-amino]methyl]phenyl]-2-[(2-chlorophenyl)methyl]-1,2,4-triazol-3-one Openeye Name: 2-[(2-chlorophenyl)methyl]-4-[4-[[[2-(2,4-difluorophenyl)-2-hydroxy-3-(1,2,4-triazol-1-yl)propyl]-methyl-amino]methyl]phenyl]-1,2,4-triazol-3-one CAS Name: 2-[(2-chlorophenyl)methyl]-4-[4-[[[2-(2,4-difluorophenyl)-2-hydroxy-3-(1,2,4-triazol-1-yl)propyl]-methylamino]methyl]phenyl]-1,2,4-triazol-3-one IUPAC Name: 2-[(2-chlorophenyl)methyl]-4-[4-[[[2-(2,4-difluorophenyl)-2-hydroxy-3-(1,2,4-triazol-1-yl)propyl]-methylamino]methyl]phenyl]-1,2,4-triazol-3-one Traditional Name: 2-(2-chlorobenzyl)-4-[4-[[[2-(2,4-difluorophenyl)-2-hydroxy-3-(1,2,4-triazol-1-yl)propyl]-methyl-amino]methyl]phenyl]-1,2,4-triazol-3-one Formula: C28H26ClF2N7O2 MolecularWeight: 566.001546

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)N2C=NN(C2=O)CC3=CC=CC=C3Cl)CC(CN4C=NC=N4)(C5=C(C=C(C=C5)F)F)O

Isomeric SMILES

CN(CC1=CC=C(C=C1)N2C=NN(C2=O)CC3=CC=CC=C3Cl)CC(CN4C=NC=N4)(C5=C(C=C(C=C5)F)F)O

InChI

InChI=1S/C28H26ClF2N7O2/c1-35(15-28(40,16-36-18-32-17-33-36)24-11-8-22(30)12-26(24)31)13-20-6-9-23(10-7-20)37-19-34-38(27(37)39)14-21-4-2-3-5-25(21)29/h2-12,17-19,40H,13-16H2,1H3