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

Systemtic Name: 4-(4-tert-butylphenyl)-1-[(3-chlorophenyl)methyl]-2-methyl-5-pentyl-pyrrole-3-carboxamide Openeye Name: 4-(4-tert-butylphenyl)-1-[(3-chlorophenyl)methyl]-2-methyl-5-pentyl-pyrrole-3-carboxamide CAS Name: 4-(4-tert-butylphenyl)-1-[(3-chlorophenyl)methyl]-2-methyl-5-pentyl-3-pyrrolecarboxamide IUPAC Name: 4-(4-tert-butylphenyl)-1-[(3-chlorophenyl)methyl]-2-methyl-5-pentylpyrrole-3-carboxamide Traditional Name: 5-amyl-4-(4-tert-butylphenyl)-1-(3-chlorobenzyl)-2-methyl-pyrrole-3-carboxamide Formula: C28H35ClN2O MolecularWeight: 451.0433

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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(C)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C28H35ClN2O/c1-6-7-8-12-24-26(21-13-15-22(16-14-21)28(3,4)5)25(27(30)32)19(2)31(24)18-20-10-9-11-23(29)17-20/h9-11,13-17H,6-8,12,18H2,1-5H3,(H2,30,32)