N-[(3-bromanyl-5-fluoranyl-phenyl)-(1-methylpyrazol-4-yl)methyl]propan-1-amine

Systemtic Name: N-[(3-bromanyl-5-fluoranyl-phenyl)-(1-methylpyrazol-4-yl)methyl]propan-1-amine Openeye Name: N-[(3-bromo-5-fluoro-phenyl)-(1-methylpyrazol-4-yl)methyl]propan-1-amine CAS Name: N-[(3-bromo-5-fluorophenyl)-(1-methyl-4-pyrazolyl)methyl]-1-propanamine IUPAC Name: N-[(3-bromo-5-fluorophenyl)-(1-methylpyrazol-4-yl)methyl]propan-1-amine Traditional Name: [(3-bromo-5-fluoro-phenyl)-(1-methylpyrazol-4-yl)methyl]-propyl-amine Formula: C14H17BrFN3 MolecularWeight: 326.207283

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(C1=CC(=CC(=C1)Br)F)C2=CN(N=C2)C

Isomeric SMILES

CCCNC(C1=CC(=CC(=C1)Br)F)C2=CN(N=C2)C

InChI

InChI=1S/C14H17BrFN3/c1-3-4-17-14(11-8-18-19(2)9-11)10-5-12(15)7-13(16)6-10/h5-9,14,17H,3-4H2,1-2H3