3,5-dimethyl-N-[pyridin-4-yl-(1,3,5-triphenylpyrazol-4-yl)methyl]benzamide

Systemtic Name: 3,5-dimethyl-N-[pyridin-4-yl-(1,3,5-triphenylpyrazol-4-yl)methyl]benzamide Openeye Name: 3,5-dimethyl-N-[4-pyridyl-(1,3,5-triphenylpyrazol-4-yl)methyl]benzamide CAS Name: 3,5-dimethyl-N-[pyridin-4-yl-(1,3,5-triphenyl-4-pyrazolyl)methyl]benzamide IUPAC Name: 3,5-dimethyl-N-[pyridin-4-yl-(1,3,5-triphenylpyrazol-4-yl)methyl]benzamide Traditional Name: 3,5-dimethyl-N-[4-pyridyl-(1,3,5-triphenylpyrazol-4-yl)methyl]benzamide Formula: C36H30N4O MolecularWeight: 534.6496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)NC(C2=CC=NC=C2)C3=C(N(N=C3C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)NC(C2=CC=NC=C2)C3=C(N(N=C3C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6)C

InChI

InChI=1S/C36H30N4O/c1-25-22-26(2)24-30(23-25)36(41)38-33(28-18-20-37-21-19-28)32-34(27-12-6-3-7-13-27)39-40(31-16-10-5-11-17-31)35(32)29-14-8-4-9-15-29/h3-24,33H,1-2H3,(H,38,41)