5-butyl-4-(4-chlorophenyl)-1-[3-(dimethylamino)propyl]-2-methyl-pyrrole-3-carboxamide

Systemtic Name: 5-butyl-4-(4-chlorophenyl)-1-[3-(dimethylamino)propyl]-2-methyl-pyrrole-3-carboxamide Openeye Name: 5-butyl-4-(4-chlorophenyl)-1-[3-(dimethylamino)propyl]-2-methyl-pyrrole-3-carboxamide CAS Name: 5-butyl-4-(4-chlorophenyl)-1-[3-(dimethylamino)propyl]-2-methyl-3-pyrrolecarboxamide IUPAC Name: 5-butyl-4-(4-chlorophenyl)-1-[3-(dimethylamino)propyl]-2-methylpyrrole-3-carboxamide Traditional Name: 5-butyl-4-(4-chlorophenyl)-1-[3-(dimethylamino)propyl]-2-methyl-pyrrole-3-carboxamide Formula: C21H30ClN3O MolecularWeight: 375.9354

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=C(N1CCCN(C)C)C)C(=O)N)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCCCC1=C(C(=C(N1CCCN(C)C)C)C(=O)N)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C21H30ClN3O/c1-5-6-8-18-20(16-9-11-17(22)12-10-16)19(21(23)26)15(2)25(18)14-7-13-24(3)4/h9-12H,5-8,13-14H2,1-4H3,(H2,23,26)