1-[(3-chlorophenyl)methyl]-4-(4-cyanophenyl)-2-methyl-5-pentyl-pyrrole-3-carboxamide

Systemtic Name: 1-[(3-chlorophenyl)methyl]-4-(4-cyanophenyl)-2-methyl-5-pentyl-pyrrole-3-carboxamide Openeye Name: 1-[(3-chlorophenyl)methyl]-4-(4-cyanophenyl)-2-methyl-5-pentyl-pyrrole-3-carboxamide CAS Name: 1-[(3-chlorophenyl)methyl]-4-(4-cyanophenyl)-2-methyl-5-pentyl-3-pyrrolecarboxamide IUPAC Name: 1-[(3-chlorophenyl)methyl]-4-(4-cyanophenyl)-2-methyl-5-pentylpyrrole-3-carboxamide Traditional Name: 5-amyl-1-(3-chlorobenzyl)-4-(4-cyanophenyl)-2-methyl-pyrrole-3-carboxamide Formula: C25H26ClN3O MolecularWeight: 419.94644

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C(=C(N1CC2=CC(=CC=C2)Cl)C)C(=O)N)C3=CC=C(C=C3)C#N

Isomeric SMILES

CCCCCC1=C(C(=C(N1CC2=CC(=CC=C2)Cl)C)C(=O)N)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C25H26ClN3O/c1-3-4-5-9-22-24(20-12-10-18(15-27)11-13-20)23(25(28)30)17(2)29(22)16-19-7-6-8-21(26)14-19/h6-8,10-14H,3-5,9,16H2,1-2H3,(H2,28,30)