3-[(4-azanylpyrazol-1-yl)methyl]-4-fluoranyl-benzenecarbonitrile

Systemtic Name: 3-[(4-azanylpyrazol-1-yl)methyl]-4-fluoranyl-benzenecarbonitrile Openeye Name: 3-[(4-aminopyrazol-1-yl)methyl]-4-fluoro-benzonitrile CAS Name: 3-[(4-amino-1-pyrazolyl)methyl]-4-fluorobenzonitrile IUPAC Name: 3-[(4-aminopyrazol-1-yl)methyl]-4-fluorobenzonitrile Traditional Name: 3-[(4-aminopyrazol-1-yl)methyl]-4-fluoro-benzonitrile Formula: C11H9FN4 MolecularWeight: 216.214363

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C#N)CN2C=C(C=N2)N)F

Isomeric SMILES

C1=CC(=C(C=C1C#N)CN2C=C(C=N2)N)F

InChI

InChI=1S/C11H9FN4/c12-11-2-1-8(4-13)3-9(11)6-16-7-10(14)5-15-16/h1-3,5,7H,6,14H2