2-[4-[3-(benzimidazol-1-yl)phenyl]sulfanylphenyl]oxane-4-carboxamide

Systemtic Name: 2-[4-[3-(benzimidazol-1-yl)phenyl]sulfanylphenyl]oxane-4-carboxamide Openeye Name: 2-[4-[3-(benzimidazol-1-yl)phenyl]sulfanylphenyl]tetrahydropyran-4-carboxamide CAS Name: 2-[4-[[3-(1-benzimidazolyl)phenyl]thio]phenyl]-4-oxanecarboxamide IUPAC Name: 2-[4-[3-(benzimidazol-1-yl)phenyl]sulfanylphenyl]oxane-4-carboxamide Traditional Name: 2-[4-[[3-(benzimidazol-1-yl)phenyl]thio]phenyl]tetrahydropyran-4-carboxamide Formula: C25H23N3O2S MolecularWeight: 429.53402

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(CC1C(=O)N)C2=CC=C(C=C2)SC3=CC=CC(=C3)N4C=NC5=CC=CC=C54

Isomeric SMILES

C1COC(CC1C(=O)N)C2=CC=C(C=C2)SC3=CC=CC(=C3)N4C=NC5=CC=CC=C54

InChI

InChI=1S/C25H23N3O2S/c26-25(29)18-12-13-30-24(14-18)17-8-10-20(11-9-17)31-21-5-3-4-19(15-21)28-16-27-22-6-1-2-7-23(22)28/h1-11,15-16,18,24H,12-14H2,(H2,26,29)