N-[(4-bromanyl-2-fluoranyl-phenyl)methyl]-3-(1H-pyrazol-5-yl)aniline

Systemtic Name: N-[(4-bromanyl-2-fluoranyl-phenyl)methyl]-3-(1H-pyrazol-5-yl)aniline Openeye Name: N-[(4-bromo-2-fluoro-phenyl)methyl]-3-(1H-pyrazol-5-yl)aniline CAS Name: N-[(4-bromo-2-fluorophenyl)methyl]-3-(1H-pyrazol-5-yl)aniline IUPAC Name: N-[(4-bromo-2-fluorophenyl)methyl]-3-(1H-pyrazol-5-yl)aniline Traditional Name: (4-bromo-2-fluoro-benzyl)-[3-(1H-pyrazol-5-yl)phenyl]amine Formula: C16H13BrFN3 MolecularWeight: 346.196923

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NCC2=C(C=C(C=C2)Br)F)C3=CC=NN3

Isomeric SMILES

C1=CC(=CC(=C1)NCC2=C(C=C(C=C2)Br)F)C3=CC=NN3

InChI

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