5-butyl-1-[(3-chlorophenyl)methyl]-2-methyl-4-pyridin-3-yl-pyrrole-3-carboxamide

Systemtic Name: 5-butyl-1-[(3-chlorophenyl)methyl]-2-methyl-4-pyridin-3-yl-pyrrole-3-carboxamide Openeye Name: 5-butyl-1-[(3-chlorophenyl)methyl]-2-methyl-4-(3-pyridyl)pyrrole-3-carboxamide CAS Name: 5-butyl-1-[(3-chlorophenyl)methyl]-2-methyl-4-(3-pyridinyl)-3-pyrrolecarboxamide IUPAC Name: 5-butyl-1-[(3-chlorophenyl)methyl]-2-methyl-4-pyridin-3-ylpyrrole-3-carboxamide Traditional Name: 5-butyl-1-(3-chlorobenzyl)-2-methyl-4-(3-pyridyl)pyrrole-3-carboxamide Formula: C22H24ClN3O MolecularWeight: 381.89846

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=C(N1CC2=CC(=CC=C2)Cl)C)C(=O)N)C3=CN=CC=C3

Isomeric SMILES

CCCCC1=C(C(=C(N1CC2=CC(=CC=C2)Cl)C)C(=O)N)C3=CN=CC=C3

InChI

InChI=1S/C22H24ClN3O/c1-3-4-10-19-21(17-8-6-11-25-13-17)20(22(24)27)15(2)26(19)14-16-7-5-9-18(23)12-16/h5-9,11-13H,3-4,10,14H2,1-2H3,(H2,24,27)