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

Systemtic Name: 1-[(3-chlorophenyl)methyl]-4-(4-cyanophenyl)-2-methyl-5-propyl-pyrrole-3-carboxamide Openeye Name: 1-[(3-chlorophenyl)methyl]-4-(4-cyanophenyl)-2-methyl-5-propyl-pyrrole-3-carboxamide CAS Name: 1-[(3-chlorophenyl)methyl]-4-(4-cyanophenyl)-2-methyl-5-propyl-3-pyrrolecarboxamide IUPAC Name: 1-[(3-chlorophenyl)methyl]-4-(4-cyanophenyl)-2-methyl-5-propylpyrrole-3-carboxamide Traditional Name: 1-(3-chlorobenzyl)-4-(4-cyanophenyl)-2-methyl-5-propyl-pyrrole-3-carboxamide Formula: C23H22ClN3O MolecularWeight: 391.89328

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=C(N1CC2=CC(=CC=C2)Cl)C)C(=O)N)C3=CC=C(C=C3)C#N

Isomeric SMILES

CCCC1=C(C(=C(N1CC2=CC(=CC=C2)Cl)C)C(=O)N)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C23H22ClN3O/c1-3-5-20-22(18-10-8-16(13-25)9-11-18)21(23(26)28)15(2)27(20)14-17-6-4-7-19(24)12-17/h4,6-12H,3,5,14H2,1-2H3,(H2,26,28)