1-[[3-ethyl-5-(2-fluoranylphenoxy)-1-phenyl-pyrazol-4-yl]methyl-propyl-amino]hex-5-en-2-ol

Systemtic Name: 1-[[3-ethyl-5-(2-fluoranylphenoxy)-1-phenyl-pyrazol-4-yl]methyl-propyl-amino]hex-5-en-2-ol Openeye Name: 1-[[3-ethyl-5-(2-fluorophenoxy)-1-phenyl-pyrazol-4-yl]methyl-propyl-amino]hex-5-en-2-ol CAS Name: 1-[[3-ethyl-5-(2-fluorophenoxy)-1-phenyl-4-pyrazolyl]methyl-propylamino]-5-hexen-2-ol IUPAC Name: 1-[[3-ethyl-5-(2-fluorophenoxy)-1-phenylpyrazol-4-yl]methyl-propylamino]hex-5-en-2-ol Traditional Name: 1-[[3-ethyl-5-(2-fluorophenoxy)-1-phenyl-pyrazol-4-yl]methyl-propyl-amino]hex-5-en-2-ol Formula: C27H34FN3O2 MolecularWeight: 451.576163

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=C(N(N=C1CC)C2=CC=CC=C2)OC3=CC=CC=C3F)CC(CCC=C)O

Isomeric SMILES

CCCN(CC1=C(N(N=C1CC)C2=CC=CC=C2)OC3=CC=CC=C3F)CC(CCC=C)O

InChI

InChI=1S/C27H34FN3O2/c1-4-7-15-22(32)19-30(18-5-2)20-23-25(6-3)29-31(21-13-9-8-10-14-21)27(23)33-26-17-12-11-16-24(26)28/h4,8-14,16-17,22,32H,1,5-7,15,18-20H2,2-3H3