4-(4-cyanophenyl)-2-methyl-5-pentyl-1-(phenylmethyl)pyrrole-3-carboxamide

Systemtic Name: 4-(4-cyanophenyl)-2-methyl-5-pentyl-1-(phenylmethyl)pyrrole-3-carboxamide Openeye Name: 1-benzyl-4-(4-cyanophenyl)-2-methyl-5-pentyl-pyrrole-3-carboxamide CAS Name: 4-(4-cyanophenyl)-2-methyl-5-pentyl-1-(phenylmethyl)-3-pyrrolecarboxamide IUPAC Name: 1-benzyl-4-(4-cyanophenyl)-2-methyl-5-pentylpyrrole-3-carboxamide Traditional Name: 5-amyl-1-benzyl-4-(4-cyanophenyl)-2-methyl-pyrrole-3-carboxamide Formula: C25H27N3O MolecularWeight: 385.50138

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H27N3O/c1-3-4-6-11-22-24(21-14-12-19(16-26)13-15-21)23(25(27)29)18(2)28(22)17-20-9-7-5-8-10-20/h5,7-10,12-15H,3-4,6,11,17H2,1-2H3,(H2,27,29)