N-[3-[5-azanyl-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propyl]-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: N-[3-[5-azanyl-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propyl]-1-phenyl-pyrazole-4-carboxamide Openeye Name: N-[3-[5-amino-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propyl]-1-phenyl-pyrazole-4-carboxamide CAS Name: N-[3-[5-amino-4-cyano-1-(4-fluorophenyl)-3-pyrazolyl]propyl]-1-phenyl-4-pyrazolecarboxamide IUPAC Name: N-[3-[5-amino-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propyl]-1-phenylpyrazole-4-carboxamide Traditional Name: N-[3-[5-amino-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propyl]-1-phenyl-pyrazole-4-carboxamide Formula: C23H20FN7O MolecularWeight: 429.449603

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C=N2)C(=O)NCCCC3=NN(C(=C3C#N)N)C4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C=N2)C(=O)NCCCC3=NN(C(=C3C#N)N)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H20FN7O/c24-17-8-10-19(11-9-17)31-22(26)20(13-25)21(29-31)7-4-12-27-23(32)16-14-28-30(15-16)18-5-2-1-3-6-18/h1-3,5-6,8-11,14-15H,4,7,12,26H2,(H,27,32)