N-[1-(phenylmethyl)pyrrolidin-3-yl]-2-[4-(pyrazol-1-ylmethyl)phenyl]benzamide

Systemtic Name: N-[1-(phenylmethyl)pyrrolidin-3-yl]-2-[4-(pyrazol-1-ylmethyl)phenyl]benzamide Openeye Name: N-(1-benzylpyrrolidin-3-yl)-2-[4-(pyrazol-1-ylmethyl)phenyl]benzamide CAS Name: N-[1-(phenylmethyl)-3-pyrrolidinyl]-2-[4-(1-pyrazolylmethyl)phenyl]benzamide IUPAC Name: N-(1-benzylpyrrolidin-3-yl)-2-[4-(pyrazol-1-ylmethyl)phenyl]benzamide Traditional Name: N-(1-benzylpyrrolidin-3-yl)-2-[4-(pyrazol-1-ylmethyl)phenyl]benzamide Formula: C28H28N4O MolecularWeight: 436.54812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1NC(=O)C2=CC=CC=C2C3=CC=C(C=C3)CN4C=CC=N4)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CC1NC(=O)C2=CC=CC=C2C3=CC=C(C=C3)CN4C=CC=N4)CC5=CC=CC=C5

InChI

InChI=1S/C28H28N4O/c33-28(30-25-15-18-31(21-25)19-22-7-2-1-3-8-22)27-10-5-4-9-26(27)24-13-11-23(12-14-24)20-32-17-6-16-29-32/h1-14,16-17,25H,15,18-21H2,(H,30,33)