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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1(C2=CC(=CC=C2)SC3=CC=C(C=C3)N4C=NC5=CC=CC=C54)C(=O)N

Isomeric SMILES

C1COCCC1(C2=CC(=CC=C2)SC3=CC=C(C=C3)N4C=NC5=CC=CC=C54)C(=O)N

InChI

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