2-methyl-5-pentyl-4-(4-phenylphenyl)-1-(pyridin-2-ylmethyl)pyrrole-3-carboxamide

Systemtic Name: 2-methyl-5-pentyl-4-(4-phenylphenyl)-1-(pyridin-2-ylmethyl)pyrrole-3-carboxamide Openeye Name: 2-methyl-5-pentyl-4-(4-phenylphenyl)-1-(2-pyridylmethyl)pyrrole-3-carboxamide CAS Name: 2-methyl-5-pentyl-4-(4-phenylphenyl)-1-(2-pyridinylmethyl)-3-pyrrolecarboxamide IUPAC Name: 2-methyl-5-pentyl-4-(4-phenylphenyl)-1-(pyridin-2-ylmethyl)pyrrole-3-carboxamide Traditional Name: 5-amyl-2-methyl-4-(4-phenylphenyl)-1-(2-pyridylmethyl)pyrrole-3-carboxamide Formula: C29H31N3O MolecularWeight: 437.57594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C(=C(N1CC2=CC=CC=N2)C)C(=O)N)C3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CCCCCC1=C(C(=C(N1CC2=CC=CC=N2)C)C(=O)N)C3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C29H31N3O/c1-3-4-6-14-26-28(24-17-15-23(16-18-24)22-11-7-5-8-12-22)27(29(30)33)21(2)32(26)20-25-13-9-10-19-31-25/h5,7-13,15-19H,3-4,6,14,20H2,1-2H3,(H2,30,33)