5-bromanyl-N-[(1-tert-butylpyrazol-4-yl)methyl]-2-fluoranyl-aniline

Systemtic Name: 5-bromanyl-N-[(1-tert-butylpyrazol-4-yl)methyl]-2-fluoranyl-aniline Openeye Name: 5-bromo-N-[(1-tert-butylpyrazol-4-yl)methyl]-2-fluoro-aniline CAS Name: 5-bromo-N-[(1-tert-butyl-4-pyrazolyl)methyl]-2-fluoroaniline IUPAC Name: 5-bromo-N-[(1-tert-butylpyrazol-4-yl)methyl]-2-fluoroaniline Traditional Name: (5-bromo-2-fluoro-phenyl)-[(1-tert-butylpyrazol-4-yl)methyl]amine Formula: C14H17BrFN3 MolecularWeight: 326.207283

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C=C(C=N1)CNC2=C(C=CC(=C2)Br)F

Isomeric SMILES

CC(C)(C)N1C=C(C=N1)CNC2=C(C=CC(=C2)Br)F

InChI

InChI=1S/C14H17BrFN3/c1-14(2,3)19-9-10(8-18-19)7-17-13-6-11(15)4-5-12(13)16/h4-6,8-9,17H,7H2,1-3H3