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

Systemtic Name: 1-ethoxy-3-[[3-ethyl-5-(2-fluoranylphenoxy)-1-phenyl-pyrazol-4-yl]methyl-(2-methylpropyl)amino]propan-2-ol Openeye Name: 1-ethoxy-3-[[3-ethyl-5-(2-fluorophenoxy)-1-phenyl-pyrazol-4-yl]methyl-isobutyl-amino]propan-2-ol CAS Name: 1-ethoxy-3-[[3-ethyl-5-(2-fluorophenoxy)-1-phenyl-4-pyrazolyl]methyl-(2-methylpropyl)amino]-2-propanol IUPAC Name: 1-ethoxy-3-[[3-ethyl-5-(2-fluorophenoxy)-1-phenylpyrazol-4-yl]methyl-(2-methylpropyl)amino]propan-2-ol Traditional Name: 1-ethoxy-3-[[3-ethyl-5-(2-fluorophenoxy)-1-phenyl-pyrazol-4-yl]methyl-isobutyl-amino]propan-2-ol Formula: C27H36FN3O3 MolecularWeight: 469.591443

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=C1CN(CC(C)C)CC(COCC)O)OC2=CC=CC=C2F)C3=CC=CC=C3

Isomeric SMILES

CCC1=NN(C(=C1CN(CC(C)C)CC(COCC)O)OC2=CC=CC=C2F)C3=CC=CC=C3

InChI

InChI=1S/C27H36FN3O3/c1-5-25-23(18-30(16-20(3)4)17-22(32)19-33-6-2)27(34-26-15-11-10-14-24(26)28)31(29-25)21-12-8-7-9-13-21/h7-15,20,22,32H,5-6,16-19H2,1-4H3