5-azanyl-1-(3-chloranyl-4-fluoranyl-phenyl)-3-cyclobutyl-pyrazole-4-carbonitrile

Systemtic Name: 5-azanyl-1-(3-chloranyl-4-fluoranyl-phenyl)-3-cyclobutyl-pyrazole-4-carbonitrile Openeye Name: 5-amino-1-(3-chloro-4-fluoro-phenyl)-3-cyclobutyl-pyrazole-4-carbonitrile CAS Name: 5-amino-1-(3-chloro-4-fluorophenyl)-3-cyclobutyl-4-pyrazolecarbonitrile IUPAC Name: 5-amino-1-(3-chloro-4-fluorophenyl)-3-cyclobutylpyrazole-4-carbonitrile Traditional Name: 5-amino-1-(3-chloro-4-fluoro-phenyl)-3-cyclobutyl-pyrazole-4-carbonitrile Formula: C14H12ClFN4 MolecularWeight: 290.723283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)C2=NN(C(=C2C#N)N)C3=CC(=C(C=C3)F)Cl

Isomeric SMILES

C1CC(C1)C2=NN(C(=C2C#N)N)C3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C14H12ClFN4/c15-11-6-9(4-5-12(11)16)20-14(18)10(7-17)13(19-20)8-2-1-3-8/h4-6,8H,1-3,18H2