(3S)-N-[(5-fluoranyl-2-pyrazol-1-yl-phenyl)methyl]-1-pyrimidin-2-yl-piperidin-3-amine

Systemtic Name: (3S)-N-[(5-fluoranyl-2-pyrazol-1-yl-phenyl)methyl]-1-pyrimidin-2-yl-piperidin-3-amine Openeye Name: (3S)-N-[(5-fluoro-2-pyrazol-1-yl-phenyl)methyl]-1-pyrimidin-2-yl-piperidin-3-amine CAS Name: (3S)-N-[[5-fluoro-2-(1-pyrazolyl)phenyl]methyl]-1-(2-pyrimidinyl)-3-piperidinamine IUPAC Name: (3S)-N-[(5-fluoro-2-pyrazol-1-ylphenyl)methyl]-1-pyrimidin-2-ylpiperidin-3-amine Traditional Name: (5-fluoro-2-pyrazol-1-yl-benzyl)-[(3S)-1-(2-pyrimidyl)-3-piperidyl]amine Formula: C19H21FN6 MolecularWeight: 352.408643

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NC=CC=N2)NCC3=C(C=CC(=C3)F)N4C=CC=N4

Isomeric SMILES

C1C[C@@H](CN(C1)C2=NC=CC=N2)NCC3=C(C=CC(=C3)F)N4C=CC=N4

InChI

InChI=1S/C19H21FN6/c20-16-5-6-18(26-11-3-9-24-26)15(12-16)13-23-17-4-1-10-25(14-17)19-21-7-2-8-22-19/h2-3,5-9,11-12,17,23H,1,4,10,13-14H2/t17-/m0/s1