4-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-N-prop-2-ynyl-pyrimidin-2-amine

Systemtic Name: 4-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-N-prop-2-ynyl-pyrimidin-2-amine Openeye Name: 4-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-N-prop-2-ynyl-pyrimidin-2-amine CAS Name: 4-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-N-prop-2-ynyl-2-pyrimidinamine IUPAC Name: 4-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-N-prop-2-ynylpyrimidin-2-amine Traditional Name: [4-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]pyrimidin-2-yl]-propargyl-amine Formula: C16H12FN5 MolecularWeight: 293.298383

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNC1=NC=CC(=N1)C2=C(NN=C2)C3=CC=C(C=C3)F

Isomeric SMILES

C#CCNC1=NC=CC(=N1)C2=C(NN=C2)C3=CC=C(C=C3)F

InChI

InChI=1S/C16H12FN5/c1-2-8-18-16-19-9-7-14(21-16)13-10-20-22-15(13)11-3-5-12(17)6-4-11/h1,3-7,9-10H,8H2,(H,20,22)(H,18,19,21)