N-(4-cyanophenyl)-3-(4-methylphenyl)-1-(phenylmethyl)pyrazole-4-carboxamide

Systemtic Name: N-(4-cyanophenyl)-3-(4-methylphenyl)-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: 1-benzyl-N-(4-cyanophenyl)-3-(p-tolyl)pyrazole-4-carboxamide CAS Name: N-(4-cyanophenyl)-3-(4-methylphenyl)-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-N-(4-cyanophenyl)-3-(4-methylphenyl)pyrazole-4-carboxamide Traditional Name: 1-benzyl-N-(4-cyanophenyl)-3-(p-tolyl)pyrazole-4-carboxamide Formula: C25H20N4O MolecularWeight: 392.4525

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C=C2C(=O)NC3=CC=C(C=C3)C#N)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C=C2C(=O)NC3=CC=C(C=C3)C#N)CC4=CC=CC=C4

InChI

InChI=1S/C25H20N4O/c1-18-7-11-21(12-8-18)24-23(17-29(28-24)16-20-5-3-2-4-6-20)25(30)27-22-13-9-19(15-26)10-14-22/h2-14,17H,16H2,1H3,(H,27,30)