N-(oxan-4-yl)-1-[3-(1H-pyrrol-2-yl)phenyl]benzimidazole-5-carboxamide

Systemtic Name: N-(oxan-4-yl)-1-[3-(1H-pyrrol-2-yl)phenyl]benzimidazole-5-carboxamide Openeye Name: 1-[3-(1H-pyrrol-2-yl)phenyl]-N-tetrahydropyran-4-yl-benzimidazole-5-carboxamide CAS Name: N-(4-oxanyl)-1-[3-(1H-pyrrol-2-yl)phenyl]-5-benzimidazolecarboxamide IUPAC Name: N-(oxan-4-yl)-1-[3-(1H-pyrrol-2-yl)phenyl]benzimidazole-5-carboxamide Traditional Name: 1-[3-(1H-pyrrol-2-yl)phenyl]-N-tetrahydropyran-4-yl-benzimidazole-5-carboxamide Formula: C23H22N4O2 MolecularWeight: 386.44638

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1NC(=O)C2=CC3=C(C=C2)N(C=N3)C4=CC=CC(=C4)C5=CC=CN5

Isomeric SMILES

C1COCCC1NC(=O)C2=CC3=C(C=C2)N(C=N3)C4=CC=CC(=C4)C5=CC=CN5

InChI

InChI=1S/C23H22N4O2/c28-23(26-18-8-11-29-12-9-18)17-6-7-22-21(14-17)25-15-27(22)19-4-1-3-16(13-19)20-5-2-10-24-20/h1-7,10,13-15,18,24H,8-9,11-12H2,(H,26,28)