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

Systemtic Name: 1-[[3-ethyl-5-(4-fluoranylphenoxy)-1-phenyl-pyrazol-4-yl]methyl-(2-methylpropyl)amino]butan-2-ol Openeye Name: 1-[[3-ethyl-5-(4-fluorophenoxy)-1-phenyl-pyrazol-4-yl]methyl-isobutyl-amino]butan-2-ol CAS Name: 1-[[3-ethyl-5-(4-fluorophenoxy)-1-phenyl-4-pyrazolyl]methyl-(2-methylpropyl)amino]-2-butanol IUPAC Name: 1-[[3-ethyl-5-(4-fluorophenoxy)-1-phenylpyrazol-4-yl]methyl-(2-methylpropyl)amino]butan-2-ol Traditional Name: 1-[[3-ethyl-5-(4-fluorophenoxy)-1-phenyl-pyrazol-4-yl]methyl-isobutyl-amino]butan-2-ol Formula: C26H34FN3O2 MolecularWeight: 439.565463

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H34FN3O2/c1-5-22(31)17-29(16-19(3)4)18-24-25(6-2)28-30(21-10-8-7-9-11-21)26(24)32-23-14-12-20(27)13-15-23/h7-15,19,22,31H,5-6,16-18H2,1-4H3