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

Systemtic Name: N-[3-[5-azanyl-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propyl]-5-bromanyl-pyridine-3-carboxamide Openeye Name: N-[3-[5-amino-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propyl]-5-bromo-pyridine-3-carboxamide CAS Name: N-[3-[5-amino-4-cyano-1-(4-fluorophenyl)-3-pyrazolyl]propyl]-5-bromo-3-pyridinecarboxamide IUPAC Name: N-[3-[5-amino-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propyl]-5-bromopyridine-3-carboxamide Traditional Name: N-[3-[5-amino-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propyl]-5-bromo-nicotinamide Formula: C19H16BrFN6O MolecularWeight: 443.272343

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C(=C(C(=N2)CCCNC(=O)C3=CC(=CN=C3)Br)C#N)N)F

Isomeric SMILES

C1=CC(=CC=C1N2C(=C(C(=N2)CCCNC(=O)C3=CC(=CN=C3)Br)C#N)N)F

InChI

InChI=1S/C19H16BrFN6O/c20-13-8-12(10-24-11-13)19(28)25-7-1-2-17-16(9-22)18(23)27(26-17)15-5-3-14(21)4-6-15/h3-6,8,10-11H,1-2,7,23H2,(H,25,28)