(1S)-N-[(8-fluoranylquinolin-2-yl)methyl]-1-(5-methyl-1-phenyl-pyrazol-4-yl)ethanamine

Systemtic Name: (1S)-N-[(8-fluoranylquinolin-2-yl)methyl]-1-(5-methyl-1-phenyl-pyrazol-4-yl)ethanamine Openeye Name: (1S)-N-[(8-fluoro-2-quinolyl)methyl]-1-(5-methyl-1-phenyl-pyrazol-4-yl)ethanamine CAS Name: (1S)-N-[(8-fluoro-2-quinolinyl)methyl]-1-(5-methyl-1-phenyl-4-pyrazolyl)ethanamine IUPAC Name: (1S)-N-[(8-fluoroquinolin-2-yl)methyl]-1-(5-methyl-1-phenylpyrazol-4-yl)ethanamine Traditional Name: (8-fluoro-2-quinolyl)methyl-[(1S)-1-(5-methyl-1-phenyl-pyrazol-4-yl)ethyl]amine Formula: C22H21FN4 MolecularWeight: 360.427343

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=CC=C2)C(C)NCC3=NC4=C(C=CC=C4F)C=C3

Isomeric SMILES

CC1=C(C=NN1C2=CC=CC=C2)[C@H](C)NCC3=NC4=C(C=CC=C4F)C=C3

InChI

InChI=1S/C22H21FN4/c1-15(20-14-25-27(16(20)2)19-8-4-3-5-9-19)24-13-18-12-11-17-7-6-10-21(23)22(17)26-18/h3-12,14-15,24H,13H2,1-2H3/t15-/m0/s1