3-chloranyl-N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-2-fluoranyl-aniline

Systemtic Name: 3-chloranyl-N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-2-fluoranyl-aniline Openeye Name: 3-chloro-N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-2-fluoro-aniline CAS Name: 3-chloro-N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-2-fluoroaniline IUPAC Name: 3-chloro-N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-2-fluoroaniline Traditional Name: (3-chloro-2-fluoro-phenyl)-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]amine Formula: C12H13ClFN3 MolecularWeight: 253.703123

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)CNC2=C(C(=CC=C2)Cl)F

Isomeric SMILES

CC1=C(C(=NN1)C)CNC2=C(C(=CC=C2)Cl)F

InChI

InChI=1S/C12H13ClFN3/c1-7-9(8(2)17-16-7)6-15-11-5-3-4-10(13)12(11)14/h3-5,15H,6H2,1-2H3,(H,16,17)