2,5-dimethyl-1-(4-propan-2-ylphenyl)-N-(pyridin-2-ylmethyl)pyrrole-3-carboxamide

Systemtic Name: 2,5-dimethyl-1-(4-propan-2-ylphenyl)-N-(pyridin-2-ylmethyl)pyrrole-3-carboxamide Openeye Name: 1-(4-isopropylphenyl)-2,5-dimethyl-N-(2-pyridylmethyl)pyrrole-3-carboxamide CAS Name: 2,5-dimethyl-1-(4-propan-2-ylphenyl)-N-(2-pyridinylmethyl)-3-pyrrolecarboxamide IUPAC Name: 2,5-dimethyl-1-(4-propan-2-ylphenyl)-N-(pyridin-2-ylmethyl)pyrrole-3-carboxamide Traditional Name: 2,5-dimethyl-1-p-cumenyl-N-(2-pyridylmethyl)pyrrole-3-carboxamide Formula: C22H25N3O MolecularWeight: 347.4534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)C(C)C)C)C(=O)NCC3=CC=CC=N3

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)C(C)C)C)C(=O)NCC3=CC=CC=N3

InChI

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