N-[(5-bromanyl-2-fluoranyl-phenyl)methyl]-4-pyrazol-1-yl-aniline

Systemtic Name: N-[(5-bromanyl-2-fluoranyl-phenyl)methyl]-4-pyrazol-1-yl-aniline Openeye Name: N-[(5-bromo-2-fluoro-phenyl)methyl]-4-pyrazol-1-yl-aniline CAS Name: N-[(5-bromo-2-fluorophenyl)methyl]-4-(1-pyrazolyl)aniline IUPAC Name: N-[(5-bromo-2-fluorophenyl)methyl]-4-pyrazol-1-ylaniline Traditional Name: (5-bromo-2-fluoro-benzyl)-(4-pyrazol-1-ylphenyl)amine Formula: C16H13BrFN3 MolecularWeight: 346.196923

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(N=C1)C2=CC=C(C=C2)NCC3=C(C=CC(=C3)Br)F

Isomeric SMILES

C1=CN(N=C1)C2=CC=C(C=C2)NCC3=C(C=CC(=C3)Br)F

InChI

InChI=1S/C16H13BrFN3/c17-13-2-7-16(18)12(10-13)11-19-14-3-5-15(6-4-14)21-9-1-8-20-21/h1-10,19H,11H2