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

Systemtic Name: 1-[[3-ethyl-5-(4-fluoranylphenoxy)-1-phenyl-pyrazol-4-yl]methyl-(2-methylpropyl)amino]-3-propan-2-yloxy-propan-2-ol Openeye Name: 1-[[3-ethyl-5-(4-fluorophenoxy)-1-phenyl-pyrazol-4-yl]methyl-isobutyl-amino]-3-isopropoxy-propan-2-ol CAS Name: 1-[[3-ethyl-5-(4-fluorophenoxy)-1-phenyl-4-pyrazolyl]methyl-(2-methylpropyl)amino]-3-propan-2-yloxy-2-propanol IUPAC Name: 1-[[3-ethyl-5-(4-fluorophenoxy)-1-phenylpyrazol-4-yl]methyl-(2-methylpropyl)amino]-3-propan-2-yloxypropan-2-ol Traditional Name: 1-[[3-ethyl-5-(4-fluorophenoxy)-1-phenyl-pyrazol-4-yl]methyl-isobutyl-amino]-3-isopropoxy-propan-2-ol Formula: C28H38FN3O3 MolecularWeight: 483.618023

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H38FN3O3/c1-6-27-26(18-31(16-20(2)3)17-24(33)19-34-21(4)5)28(35-25-14-12-22(29)13-15-25)32(30-27)23-10-8-7-9-11-23/h7-15,20-21,24,33H,6,16-19H2,1-5H3