N-[[5-(2-bromanyl-4-fluoranyl-phenoxy)-1,3-dimethyl-pyrazol-4-yl]methyl]cyclopropanamine

Systemtic Name: N-[[5-(2-bromanyl-4-fluoranyl-phenoxy)-1,3-dimethyl-pyrazol-4-yl]methyl]cyclopropanamine Openeye Name: N-[[5-(2-bromo-4-fluoro-phenoxy)-1,3-dimethyl-pyrazol-4-yl]methyl]cyclopropanamine CAS Name: N-[[5-(2-bromo-4-fluorophenoxy)-1,3-dimethyl-4-pyrazolyl]methyl]cyclopropanamine IUPAC Name: N-[[5-(2-bromo-4-fluorophenoxy)-1,3-dimethylpyrazol-4-yl]methyl]cyclopropanamine Traditional Name: [5-(2-bromo-4-fluoro-phenoxy)-1,3-dimethyl-pyrazol-4-yl]methyl-cyclopropyl-amine Formula: C15H17BrFN3O MolecularWeight: 354.217383

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1CNC2CC2)OC3=C(C=C(C=C3)F)Br)C

Isomeric SMILES

CC1=NN(C(=C1CNC2CC2)OC3=C(C=C(C=C3)F)Br)C

InChI

InChI=1S/C15H17BrFN3O/c1-9-12(8-18-11-4-5-11)15(20(2)19-9)21-14-6-3-10(17)7-13(14)16/h3,6-7,11,18H,4-5,8H2,1-2H3