2-[2,4-bis(fluoranyl)phenyl]-1-[4-[3-(4-bromanylphenoxy)propyl]piperazin-1-yl]-3-(1,2,4-triazol-1-yl)propan-2-ol

Systemtic Name: 2-[2,4-bis(fluoranyl)phenyl]-1-[4-[3-(4-bromanylphenoxy)propyl]piperazin-1-yl]-3-(1,2,4-triazol-1-yl)propan-2-ol Openeye Name: 1-[4-[3-(4-bromophenoxy)propyl]piperazin-1-yl]-2-(2,4-difluorophenyl)-3-(1,2,4-triazol-1-yl)propan-2-ol CAS Name: 1-[4-[3-(4-bromophenoxy)propyl]-1-piperazinyl]-2-(2,4-difluorophenyl)-3-(1,2,4-triazol-1-yl)-2-propanol IUPAC Name: 1-[4-[3-(4-bromophenoxy)propyl]piperazin-1-yl]-2-(2,4-difluorophenyl)-3-(1,2,4-triazol-1-yl)propan-2-ol Traditional Name: 1-[4-[3-(4-bromophenoxy)propyl]piperazino]-2-(2,4-difluorophenyl)-3-(1,2,4-triazol-1-yl)propan-2-ol Formula: C24H28BrF2N5O2 MolecularWeight: 536.412226

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCOC2=CC=C(C=C2)Br)CC(CN3C=NC=N3)(C4=C(C=C(C=C4)F)F)O

Isomeric SMILES

C1CN(CCN1CCCOC2=CC=C(C=C2)Br)CC(CN3C=NC=N3)(C4=C(C=C(C=C4)F)F)O

InChI

InChI=1S/C24H28BrF2N5O2/c25-19-2-5-21(6-3-19)34-13-1-8-30-9-11-31(12-10-30)15-24(33,16-32-18-28-17-29-32)22-7-4-20(26)14-23(22)27/h2-7,14,17-18,33H,1,8-13,15-16H2