N-[[5-[2,4-bis(fluoranyl)phenyl]-1H-pyrazol-4-yl]methyl]-1-pyrimidin-4-yl-ethanamine

Systemtic Name: N-[[5-[2,4-bis(fluoranyl)phenyl]-1H-pyrazol-4-yl]methyl]-1-pyrimidin-4-yl-ethanamine Openeye Name: N-[[5-(2,4-difluorophenyl)-1H-pyrazol-4-yl]methyl]-1-pyrimidin-4-yl-ethanamine CAS Name: N-[[5-(2,4-difluorophenyl)-1H-pyrazol-4-yl]methyl]-1-(4-pyrimidinyl)ethanamine IUPAC Name: N-[[5-(2,4-difluorophenyl)-1H-pyrazol-4-yl]methyl]-1-pyrimidin-4-ylethanamine Traditional Name: [5-(2,4-difluorophenyl)-1H-pyrazol-4-yl]methyl-[1-(4-pyrimidyl)ethyl]amine Formula: C16H15F2N5 MolecularWeight: 315.320606

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC=NC=C1)NCC2=C(NN=C2)C3=C(C=C(C=C3)F)F

Isomeric SMILES

CC(C1=NC=NC=C1)NCC2=C(NN=C2)C3=C(C=C(C=C3)F)F

InChI

InChI=1S/C16H15F2N5/c1-10(15-4-5-19-9-21-15)20-7-11-8-22-23-16(11)13-3-2-12(17)6-14(13)18/h2-6,8-10,20H,7H2,1H3,(H,22,23)