1-[3-[2,4-bis(fluoranyl)phenyl]-3-oxidanyl-4-(1,2,4-triazol-1-yl)butan-2-yl]-4-[4-[1,1,2,2-tetrakis(fluoranyl)ethoxy]phenyl]piperazine-2,3-dione

Systemtic Name: 1-[3-[2,4-bis(fluoranyl)phenyl]-3-oxidanyl-4-(1,2,4-triazol-1-yl)butan-2-yl]-4-[4-[1,1,2,2-tetrakis(fluoranyl)ethoxy]phenyl]piperazine-2,3-dione Openeye Name: 1-[2-(2,4-difluorophenyl)-2-hydroxy-1-methyl-3-(1,2,4-triazol-1-yl)propyl]-4-[4-(1,1,2,2-tetrafluoroethoxy)phenyl]piperazine-2,3-dione CAS Name: 1-[3-(2,4-difluorophenyl)-3-hydroxy-4-(1,2,4-triazol-1-yl)butan-2-yl]-4-[4-(1,1,2,2-tetrafluoroethoxy)phenyl]piperazine-2,3-dione IUPAC Name: 1-[3-(2,4-difluorophenyl)-3-hydroxy-4-(1,2,4-triazol-1-yl)butan-2-yl]-4-[4-(1,1,2,2-tetrafluoroethoxy)phenyl]piperazine-2,3-dione Traditional Name: 1-[2-(2,4-difluorophenyl)-2-hydroxy-1-methyl-3-(1,2,4-triazol-1-yl)propyl]-4-[4-(1,1,2,2-tetrafluoroethoxy)phenyl]piperazine-2,3-quinone Formula: C24H21F6N5O4 MolecularWeight: 557.445059

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CN1C=NC=N1)(C2=C(C=C(C=C2)F)F)O)N3CCN(C(=O)C3=O)C4=CC=C(C=C4)OC(C(F)F)(F)F

Isomeric SMILES

CC(C(CN1C=NC=N1)(C2=C(C=C(C=C2)F)F)O)N3CCN(C(=O)C3=O)C4=CC=C(C=C4)OC(C(F)F)(F)F

InChI

InChI=1S/C24H21F6N5O4/c1-14(23(38,11-33-13-31-12-32-33)18-7-2-15(25)10-19(18)26)34-8-9-35(21(37)20(34)36)16-3-5-17(6-4-16)39-24(29,30)22(27)28/h2-7,10,12-14,22,38H,8-9,11H2,1H3