N-(pyridin-3-ylmethyl)-1-[4-(3-pyridin-4-ylpropoxy)phenyl]benzimidazole-5-carboxamide

Systemtic Name: N-(pyridin-3-ylmethyl)-1-[4-(3-pyridin-4-ylpropoxy)phenyl]benzimidazole-5-carboxamide Openeye Name: N-(3-pyridylmethyl)-1-[4-[3-(4-pyridyl)propoxy]phenyl]benzimidazole-5-carboxamide CAS Name: N-(3-pyridinylmethyl)-1-[4-(3-pyridin-4-ylpropoxy)phenyl]-5-benzimidazolecarboxamide IUPAC Name: N-(pyridin-3-ylmethyl)-1-[4-(3-pyridin-4-ylpropoxy)phenyl]benzimidazole-5-carboxamide Traditional Name: N-(3-pyridylmethyl)-1-[4-[3-(4-pyridyl)propoxy]phenyl]benzimidazole-5-carboxamide Formula: C28H25N5O2 MolecularWeight: 463.5304

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CNC(=O)C2=CC3=C(C=C2)N(C=N3)C4=CC=C(C=C4)OCCCC5=CC=NC=C5

Isomeric SMILES

C1=CC(=CN=C1)CNC(=O)C2=CC3=C(C=C2)N(C=N3)C4=CC=C(C=C4)OCCCC5=CC=NC=C5

InChI

InChI=1S/C28H25N5O2/c34-28(31-19-22-3-1-13-30-18-22)23-5-10-27-26(17-23)32-20-33(27)24-6-8-25(9-7-24)35-16-2-4-21-11-14-29-15-12-21/h1,3,5-15,17-18,20H,2,4,16,19H2,(H,31,34)