N-[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]-4-cyano-benzamide

Systemtic Name: N-[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]-4-cyano-benzamide Openeye Name: N-[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]-4-cyano-benzamide CAS Name: N-[5-tert-butyl-2-(4-fluorophenyl)-3-pyrazolyl]-4-cyanobenzamide IUPAC Name: N-[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]-4-cyanobenzamide Traditional Name: N-[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]-4-cyano-benzamide Formula: C21H19FN4O MolecularWeight: 362.400163

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)NC(=O)C2=CC=C(C=C2)C#N)C3=CC=C(C=C3)F

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)NC(=O)C2=CC=C(C=C2)C#N)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H19FN4O/c1-21(2,3)18-12-19(26(25-18)17-10-8-16(22)9-11-17)24-20(27)15-6-4-14(13-23)5-7-15/h4-12H,1-3H3,(H,24,27)