5-butyl-2-methyl-4-(4-phenylphenyl)-1-(2-piperidin-1-ylethyl)pyrrole-3-carboxamide

Systemtic Name: 5-butyl-2-methyl-4-(4-phenylphenyl)-1-(2-piperidin-1-ylethyl)pyrrole-3-carboxamide Openeye Name: 5-butyl-2-methyl-4-(4-phenylphenyl)-1-[2-(1-piperidyl)ethyl]pyrrole-3-carboxamide CAS Name: 5-butyl-2-methyl-4-(4-phenylphenyl)-1-[2-(1-piperidinyl)ethyl]-3-pyrrolecarboxamide IUPAC Name: 5-butyl-2-methyl-4-(4-phenylphenyl)-1-(2-piperidin-1-ylethyl)pyrrole-3-carboxamide Traditional Name: 5-butyl-2-methyl-4-(4-phenylphenyl)-1-(2-piperidinoethyl)pyrrole-3-carboxamide Formula: C29H37N3O MolecularWeight: 443.62358

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=C(N1CCN2CCCCC2)C)C(=O)N)C3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CCCCC1=C(C(=C(N1CCN2CCCCC2)C)C(=O)N)C3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C29H37N3O/c1-3-4-13-26-28(25-16-14-24(15-17-25)23-11-7-5-8-12-23)27(29(30)33)22(2)32(26)21-20-31-18-9-6-10-19-31/h5,7-8,11-12,14-17H,3-4,6,9-10,13,18-21H2,1-2H3,(H2,30,33)