N-[(4-cyanophenyl)methyl]-1-(1H-imidazol-5-ylmethyl)-4-naphthalen-1-yl-pyrrole-3-carboxamide

Systemtic Name: N-[(4-cyanophenyl)methyl]-1-(1H-imidazol-5-ylmethyl)-4-naphthalen-1-yl-pyrrole-3-carboxamide Openeye Name: N-[(4-cyanophenyl)methyl]-1-(1H-imidazol-5-ylmethyl)-4-(1-naphthyl)pyrrole-3-carboxamide CAS Name: N-[(4-cyanophenyl)methyl]-1-(1H-imidazol-5-ylmethyl)-4-(1-naphthalenyl)-3-pyrrolecarboxamide IUPAC Name: N-[(4-cyanophenyl)methyl]-1-(1H-imidazol-5-ylmethyl)-4-naphthalen-1-ylpyrrole-3-carboxamide Traditional Name: N-(4-cyanobenzyl)-1-(1H-imidazol-5-ylmethyl)-4-(1-naphthyl)pyrrole-3-carboxamide Formula: C27H21N5O MolecularWeight: 431.48854

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2C3=CN(C=C3C(=O)NCC4=CC=C(C=C4)C#N)CC5=CN=CN5

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2C3=CN(C=C3C(=O)NCC4=CC=C(C=C4)C#N)CC5=CN=CN5

InChI

InChI=1S/C27H21N5O/c28-12-19-8-10-20(11-9-19)13-30-27(33)26-17-32(15-22-14-29-18-31-22)16-25(26)24-7-3-5-21-4-1-2-6-23(21)24/h1-11,14,16-18H,13,15H2,(H,29,31)(H,30,33)