1-[3-(1-methylpyrrol-2-yl)phenyl]-N-(pyridin-3-ylmethyl)benzimidazole-5-carboxamide

Systemtic Name: 1-[3-(1-methylpyrrol-2-yl)phenyl]-N-(pyridin-3-ylmethyl)benzimidazole-5-carboxamide Openeye Name: 1-[3-(1-methylpyrrol-2-yl)phenyl]-N-(3-pyridylmethyl)benzimidazole-5-carboxamide CAS Name: 1-[3-(1-methyl-2-pyrrolyl)phenyl]-N-(3-pyridinylmethyl)-5-benzimidazolecarboxamide IUPAC Name: 1-[3-(1-methylpyrrol-2-yl)phenyl]-N-(pyridin-3-ylmethyl)benzimidazole-5-carboxamide Traditional Name: 1-[3-(1-methylpyrrol-2-yl)phenyl]-N-(3-pyridylmethyl)benzimidazole-5-carboxamide Formula: C25H21N5O MolecularWeight: 407.46714

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C2=CC(=CC=C2)N3C=NC4=C3C=CC(=C4)C(=O)NCC5=CN=CC=C5

Isomeric SMILES

CN1C=CC=C1C2=CC(=CC=C2)N3C=NC4=C3C=CC(=C4)C(=O)NCC5=CN=CC=C5

InChI

InChI=1S/C25H21N5O/c1-29-12-4-8-23(29)19-6-2-7-21(13-19)30-17-28-22-14-20(9-10-24(22)30)25(31)27-16-18-5-3-11-26-15-18/h2-15,17H,16H2,1H3,(H,27,31)