2-[3-[2,4-bis(fluoranyl)phenyl]-3-oxidanyl-4-(1,2,4-triazol-1-yl)butan-2-yl]-4-[4-[2,2,3,3-tetrakis(fluoranyl)propoxy]phenyl]-1,2,4-triazole-3-thione

Systemtic Name: 2-[3-[2,4-bis(fluoranyl)phenyl]-3-oxidanyl-4-(1,2,4-triazol-1-yl)butan-2-yl]-4-[4-[2,2,3,3-tetrakis(fluoranyl)propoxy]phenyl]-1,2,4-triazole-3-thione Openeye Name: 2-[2-(2,4-difluorophenyl)-2-hydroxy-1-methyl-3-(1,2,4-triazol-1-yl)propyl]-4-[4-(2,2,3,3-tetrafluoropropoxy)phenyl]-1,2,4-triazole-3-thione CAS Name: 2-[3-(2,4-difluorophenyl)-3-hydroxy-4-(1,2,4-triazol-1-yl)butan-2-yl]-4-[4-(2,2,3,3-tetrafluoropropoxy)phenyl]-1,2,4-triazole-3-thione IUPAC Name: 2-[3-(2,4-difluorophenyl)-3-hydroxy-4-(1,2,4-triazol-1-yl)butan-2-yl]-4-[4-(2,2,3,3-tetrafluoropropoxy)phenyl]-1,2,4-triazole-3-thione Traditional Name: 2-[2-(2,4-difluorophenyl)-2-hydroxy-1-methyl-3-(1,2,4-triazol-1-yl)propyl]-4-[4-(2,2,3,3-tetrafluoropropoxy)phenyl]-1,2,4-triazole-3-thione Formula: C23H20F6N6O2S MolecularWeight: 558.499319

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CN1C=NC=N1)(C2=C(C=C(C=C2)F)F)O)N3C(=S)N(C=N3)C4=CC=C(C=C4)OCC(C(F)F)(F)F

Isomeric SMILES

CC(C(CN1C=NC=N1)(C2=C(C=C(C=C2)F)F)O)N3C(=S)N(C=N3)C4=CC=C(C=C4)OCC(C(F)F)(F)F

InChI

InChI=1S/C23H20F6N6O2S/c1-14(22(36,9-33-12-30-11-31-33)18-7-2-15(24)8-19(18)25)35-21(38)34(13-32-35)16-3-5-17(6-4-16)37-10-23(28,29)20(26)27/h2-8,11-14,20,36H,9-10H2,1H3