1-[[3-ethyl-5-(4-fluoranylphenoxy)-1-phenyl-pyrazol-4-yl]methyl-(2-methylpropyl)amino]propan-2-ol

Systemtic Name: 1-[[3-ethyl-5-(4-fluoranylphenoxy)-1-phenyl-pyrazol-4-yl]methyl-(2-methylpropyl)amino]propan-2-ol Openeye Name: 1-[[3-ethyl-5-(4-fluorophenoxy)-1-phenyl-pyrazol-4-yl]methyl-isobutyl-amino]propan-2-ol CAS Name: 1-[[3-ethyl-5-(4-fluorophenoxy)-1-phenyl-4-pyrazolyl]methyl-(2-methylpropyl)amino]-2-propanol IUPAC Name: 1-[[3-ethyl-5-(4-fluorophenoxy)-1-phenylpyrazol-4-yl]methyl-(2-methylpropyl)amino]propan-2-ol Traditional Name: 1-[[3-ethyl-5-(4-fluorophenoxy)-1-phenyl-pyrazol-4-yl]methyl-isobutyl-amino]propan-2-ol Formula: C25H32FN3O2 MolecularWeight: 425.538883

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=C1CN(CC(C)C)CC(C)O)OC2=CC=C(C=C2)F)C3=CC=CC=C3

Isomeric SMILES

CCC1=NN(C(=C1CN(CC(C)C)CC(C)O)OC2=CC=C(C=C2)F)C3=CC=CC=C3

InChI

InChI=1S/C25H32FN3O2/c1-5-24-23(17-28(15-18(2)3)16-19(4)30)25(31-22-13-11-20(26)12-14-22)29(27-24)21-9-7-6-8-10-21/h6-14,18-19,30H,5,15-17H2,1-4H3