N-[(5-chloranyl-2-fluoranyl-phenyl)-(1-methylpyrazol-4-yl)methyl]propan-1-amine

Systemtic Name: N-[(5-chloranyl-2-fluoranyl-phenyl)-(1-methylpyrazol-4-yl)methyl]propan-1-amine Openeye Name: N-[(5-chloro-2-fluoro-phenyl)-(1-methylpyrazol-4-yl)methyl]propan-1-amine CAS Name: N-[(5-chloro-2-fluorophenyl)-(1-methyl-4-pyrazolyl)methyl]-1-propanamine IUPAC Name: N-[(5-chloro-2-fluorophenyl)-(1-methylpyrazol-4-yl)methyl]propan-1-amine Traditional Name: [(5-chloro-2-fluoro-phenyl)-(1-methylpyrazol-4-yl)methyl]-propyl-amine Formula: C14H17ClFN3 MolecularWeight: 281.756283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17ClFN3/c1-3-6-17-14(10-8-18-19(2)9-10)12-7-11(15)4-5-13(12)16/h4-5,7-9,14,17H,3,6H2,1-2H3