5-butyl-2-methyl-4-phenyl-1-(pyridin-2-ylmethyl)pyrrole-3-carboxamide

Systemtic Name: 5-butyl-2-methyl-4-phenyl-1-(pyridin-2-ylmethyl)pyrrole-3-carboxamide Openeye Name: 5-butyl-2-methyl-4-phenyl-1-(2-pyridylmethyl)pyrrole-3-carboxamide CAS Name: 5-butyl-2-methyl-4-phenyl-1-(2-pyridinylmethyl)-3-pyrrolecarboxamide IUPAC Name: 5-butyl-2-methyl-4-phenyl-1-(pyridin-2-ylmethyl)pyrrole-3-carboxamide Traditional Name: 5-butyl-2-methyl-4-phenyl-1-(2-pyridylmethyl)pyrrole-3-carboxamide Formula: C22H25N3O MolecularWeight: 347.4534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=C(N1CC2=CC=CC=N2)C)C(=O)N)C3=CC=CC=C3

Isomeric SMILES

CCCCC1=C(C(=C(N1CC2=CC=CC=N2)C)C(=O)N)C3=CC=CC=C3

InChI

InChI=1S/C22H25N3O/c1-3-4-13-19-21(17-10-6-5-7-11-17)20(22(23)26)16(2)25(19)15-18-12-8-9-14-24-18/h5-12,14H,3-4,13,15H2,1-2H3,(H2,23,26)